#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t5r s ILE 4 N 0.00 0.73 -0.01 1.53 1.01 -1.26 -1.67 121.20 121.53 1t5r s ILE 4 Ca 0.00 -0.57 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1t5r s ILE 4 Cb 0.00 -0.65 -0.00 0.00 0.01 0.00 0.00 42.46 41.82 1t5r s ILE 4 CO 0.00 0.08 -0.06 -0.70 0.00 0.00 0.00 174.94 174.26 1t5r s GLU 5 N -0.56 0.51 -0.15 2.79 2.12 -0.81 -4.98 118.70 117.62 1t5r s GLU 5 Ca 0.01 -0.21 -0.19 0.00 0.36 0.00 0.00 54.97 54.95 1t5r s GLU 5 Cb -0.05 -0.50 -0.04 0.00 0.26 0.00 0.00 34.13 33.81 1t5r s GLU 5 CO 0.00 0.12 0.50 1.21 -0.54 0.00 0.00 175.26 176.55 1t5r s ASN 6 N -0.08 6.65 0.00 -1.70 3.04 -1.26 -0.31 114.94 121.28 1t5r s ASN 6 Ca 0.02 0.78 0.00 0.00 0.04 0.00 0.00 52.86 53.70 1t5r s ASN 6 Cb -0.03 -2.29 0.00 0.00 -1.54 0.00 0.00 41.25 37.38 1t5r s ASN 6 CO -0.00 -0.08 0.95 2.30 -3.04 0.00 0.00 177.10 177.23 1t5r n ILE 7 N 4.01 0.90 0.00 -5.21 -5.35 -0.81 -4.98 119.36 107.92 1t5r n ILE 7 Ca -0.06 -0.94 0.00 0.00 -0.27 0.00 0.00 62.75 61.48 1t5r n ILE 7 Cb 0.51 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.96 1t5r n ILE 7 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1t5r n GLY 8 N -0.45 0.72 3.60 3.28 0.00 -1.18 -4.62 105.19 106.54 1t5r n GLY 8 Ca 0.00 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.21 1t5r n GLY 8 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1t5r n ASP 9 N 0.00 3.34 -0.31 1.61 3.85 -1.26 -1.82 116.55 121.97 1t5r n ASP 9 Ca 0.00 0.30 -0.04 0.00 -0.71 0.00 0.00 54.79 54.34 1t5r n ASP 9 Cb 0.00 -1.54 -0.02 0.00 -1.35 0.00 0.00 41.12 38.21 1t5r n ASP 9 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1t5r n GLY 10 N 5.63 0.68 2.95 6.12 0.00 -1.26 -4.91 105.19 114.40 1t5r n GLY 10 Ca 0.29 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 1t5r n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t5r s ALA 11 N -2.03 0.73 0.16 4.61 0.00 -0.75 -2.80 121.76 121.67 1t5r s ALA 11 Ca 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 51.96 51.71 1t5r s ALA 11 Cb 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 1t5r s ALA 11 CO 0.00 0.07 0.20 -1.83 0.00 0.00 0.00 175.76 174.20 1t5r s GLU 12 N 0.46 1.10 -0.14 0.00 -1.05 -0.04 -1.92 118.70 117.11 1t5r s GLU 12 Ca -0.07 -1.33 0.00 0.00 -0.15 0.00 0.00 54.97 53.43 1t5r s GLU 12 Cb -0.10 0.32 0.02 0.00 -0.44 0.00 0.00 34.13 33.93 1t5r s GLU 12 CO 0.00 -0.37 -0.12 0.08 0.95 0.00 0.00 175.26 175.80 1t5r s VAL 13 N -4.02 1.38 -0.17 1.83 1.01 0.58 -1.26 120.40 119.75 1t5r s VAL 13 Ca 0.23 -0.51 -0.17 0.00 0.00 0.00 0.00 61.98 61.52 1t5r s VAL 13 Cb 0.05 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 1t5r s VAL 13 CO 0.03 0.43 0.46 -0.69 0.00 0.00 0.00 175.10 175.32 1t5r s VAL 14 N 1.56 5.17 -0.13 2.92 1.01 -0.43 -1.93 120.40 128.57 1t5r s VAL 14 Ca 0.05 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 1t5r s VAL 14 Cb -0.13 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1t5r s VAL 14 CO -0.10 0.26 -0.01 -0.54 0.00 0.00 0.00 175.10 174.71 1t5r s LYS 15 N 1.17 3.40 0.01 2.72 1.02 -0.67 -0.31 119.74 127.08 1t5r s LYS 15 Ca 0.23 -0.45 -0.03 0.00 0.02 0.00 0.00 55.97 55.74 1t5r s LYS 15 Cb -0.15 -2.90 -0.01 0.00 -0.52 0.00 0.00 37.83 34.25 1t5r s LYS 15 CO 0.09 0.45 0.04 1.03 -0.92 0.00 0.00 175.35 176.04 1t5r s ARG 16 N -0.19 0.39 0.04 1.68 1.81 -0.06 -3.40 118.95 119.22 1t5r s ARG 16 Ca 0.05 -0.55 -0.01 0.00 -1.72 0.00 0.00 55.73 53.50 1t5r s ARG 16 Cb -0.13 0.15 -0.03 0.00 -0.45 0.00 0.00 34.95 34.50 1t5r s ARG 16 CO 0.02 -0.08 -0.01 0.95 -0.68 0.00 0.00 175.30 175.50 1t5r s THR 17 N -1.52 0.17 -0.03 0.02 -4.23 -1.26 0.30 115.64 109.09 1t5r s THR 17 Ca -0.15 -1.38 -0.02 0.00 -1.18 0.00 0.00 61.69 58.96 1t5r s THR 17 Cb -0.08 -0.98 0.01 0.00 1.34 0.00 0.00 72.50 72.78 1t5r s THR 17 CO -0.00 -0.76 0.07 -1.61 -0.54 0.00 0.00 174.62 171.78 1t5r s GLU 18 N -2.86 0.08 -0.18 3.99 0.41 -0.91 -5.01 118.70 114.22 1t5r s GLU 18 Ca -0.03 0.10 -0.03 0.00 -0.41 0.00 0.00 54.97 54.60 1t5r s GLU 18 Cb 0.00 0.04 0.06 0.00 -1.78 0.00 0.00 34.13 32.45 1t5r s GLU 18 CO -0.06 -0.01 0.03 -0.51 -0.49 0.00 0.00 175.26 174.22 1t5r s ASP 19 N 0.03 2.74 -0.01 -0.19 1.01 -1.26 -1.07 116.67 117.92 1t5r s ASP 19 Ca -0.00 -0.73 0.05 0.00 0.71 0.00 0.00 52.55 52.57 1t5r s ASP 19 Cb -0.01 -0.57 -0.01 0.00 1.01 0.00 0.00 42.92 43.34 1t5r s ASP 19 CO 0.00 -0.29 -0.15 -0.89 0.21 0.00 0.00 175.17 174.04 1t5r s THR 20 N 1.88 1.21 0.23 -1.27 2.01 -0.84 -4.99 115.64 113.88 1t5r s THR 20 Ca -0.00 -0.65 0.06 0.00 0.31 0.00 0.00 61.69 61.41 1t5r s THR 20 Cb -0.16 -1.01 -0.05 0.00 0.01 0.00 0.00 72.50 71.28 1t5r s THR 20 CO -0.08 0.34 -0.09 -0.44 -0.69 0.00 0.00 174.62 173.67 1t5r s SER 21 N -0.34 2.48 -0.14 3.53 0.01 -1.26 -0.75 113.70 117.22 1t5r s SER 21 Ca 0.05 -1.12 -0.04 0.00 1.31 0.00 0.00 55.95 56.16 1t5r s SER 21 Cb -0.06 -0.12 0.06 0.00 0.21 0.00 0.00 66.02 66.11 1t5r s SER 21 CO -0.00 -0.30 0.12 -0.55 0.41 0.00 0.00 173.24 172.91 1t5r s SER 22 N -3.35 1.76 0.32 2.44 0.15 -0.75 -5.00 113.70 109.26 1t5r s SER 22 Ca 0.26 -0.30 0.06 0.00 0.70 0.00 0.00 55.95 56.67 1t5r s SER 22 Cb 0.02 -0.04 0.54 0.00 -1.71 0.00 0.00 66.02 64.83 1t5r s SER 22 CO 0.09 -0.32 1.77 -2.24 1.20 0.00 0.00 173.24 173.74 1t5r h ASP 23 N 8.40 0.31 0.41 5.45 3.04 -1.97 0.68 116.42 132.73 1t5r h ASP 23 Ca -0.15 -0.10 -0.02 0.00 -3.24 0.00 0.00 57.03 53.52 1t5r h ASP 23 Cb 1.14 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 39.35 1t5r h ASP 23 CO 0.25 0.58 -0.20 0.50 -2.04 0.00 0.00 179.24 178.34 1t5r h LYS 24 N 0.28 -0.53 0.00 4.15 3.64 -1.96 -3.08 116.57 119.07 1t5r h LYS 24 Ca 0.04 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1t5r h LYS 24 Cb 0.63 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1t5r h LYS 24 CO 0.05 -0.33 -0.20 0.91 -2.27 0.00 0.00 179.45 177.60 1t5r n TRP 25 N -5.31 0.38 -3.31 1.91 7.02 -1.17 -4.94 117.44 112.01 1t5r n TRP 25 Ca -0.11 0.11 -0.18 0.00 -1.02 0.00 0.00 57.50 56.30 1t5r n TRP 25 Cb 0.24 -0.62 0.06 0.00 -2.42 0.00 0.00 31.31 28.57 1t5r n TRP 25 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1t5r n GLY 26 N 1.41 -0.16 2.97 6.99 0.00 0.21 -4.72 105.19 111.89 1t5r n GLY 26 Ca 0.06 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1t5r n GLY 26 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t5r s VAL 27 N -3.24 0.07 -0.08 1.61 -7.23 -1.11 -0.83 120.40 109.59 1t5r s VAL 27 Ca 0.44 -0.57 0.04 0.00 -1.81 0.00 0.00 61.98 60.08 1t5r s VAL 27 Cb -0.19 -0.22 0.00 0.00 0.56 0.00 0.00 36.38 36.53 1t5r s VAL 27 CO 0.54 -0.31 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.91 1t5r s THR 28 N -0.94 1.85 -0.32 5.32 2.01 0.32 -1.81 115.64 122.06 1t5r s THR 28 Ca -0.10 -0.91 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 1t5r s THR 28 Cb -0.06 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.86 1t5r s THR 28 CO -0.00 0.51 0.12 -1.10 -0.69 0.00 0.00 174.62 173.46 1t5r s GLN 29 N 0.30 2.95 -0.47 4.92 -0.21 0.07 -1.22 119.66 126.01 1t5r s GLN 29 Ca -0.15 -0.96 -0.06 0.00 0.02 0.00 0.00 55.36 54.21 1t5r s GLN 29 Cb -0.17 -3.48 0.12 0.00 1.00 0.00 0.00 33.01 30.48 1t5r s GLN 29 CO 0.07 -0.54 0.31 -0.80 -2.12 0.00 0.00 175.29 172.20 1t5r s ASN 30 N 1.50 5.50 -0.09 5.90 0.02 0.69 -1.98 114.94 126.49 1t5r s ASN 30 Ca 0.02 -2.08 -0.03 0.00 -1.02 0.00 0.00 52.86 49.75 1t5r s ASN 30 Cb -0.18 -1.93 -0.04 0.00 0.02 0.00 0.00 41.25 39.13 1t5r s ASN 30 CO 0.04 -0.60 0.06 -0.63 0.02 0.00 0.00 177.10 175.99 1t5r s ILE 31 N 1.10 4.76 -0.16 0.60 -1.09 -0.24 -1.38 121.20 124.80 1t5r s ILE 31 Ca 0.08 -0.12 -0.02 0.00 -2.23 0.00 0.00 60.65 58.36 1t5r s ILE 31 Cb -0.24 -3.05 -0.02 0.00 -1.58 0.00 0.00 42.46 37.57 1t5r s ILE 31 CO -0.03 0.58 -0.07 -1.10 -1.23 0.00 0.00 174.94 173.09 1t5r s GLN 32 N -1.04 3.48 -0.36 2.79 -0.21 -0.23 -2.15 119.66 121.95 1t5r s GLN 32 Ca 0.15 -0.61 -0.02 0.00 0.02 0.00 0.00 55.36 54.90 1t5r s GLN 32 Cb -0.12 -2.84 0.08 0.00 1.00 0.00 0.00 33.01 31.14 1t5r s GLN 32 CO 0.04 0.11 0.11 -0.06 -2.12 0.00 0.00 175.29 173.37 1t5r s PHE 33 N 0.67 3.47 -0.31 0.91 0.08 0.15 -1.71 117.98 121.23 1t5r s PHE 33 Ca -0.04 -2.23 -0.06 0.00 0.12 0.00 0.00 56.93 54.72 1t5r s PHE 33 Cb -0.15 -2.73 0.03 0.00 -0.57 0.00 0.00 43.02 39.60 1t5r s PHE 33 CO 0.02 -0.90 0.08 -0.51 -0.10 0.00 0.00 175.22 173.81 1t5r s ASP 34 N 1.50 5.13 -0.16 1.36 -0.00 -0.82 -0.88 116.67 122.80 1t5r s ASP 34 Ca 0.03 -0.93 -0.20 0.00 -0.00 0.00 0.00 52.55 51.45 1t5r s ASP 34 Cb -0.21 -1.85 -0.03 0.00 -0.00 0.00 0.00 42.92 40.83 1t5r s ASP 34 CO -0.03 -0.25 0.57 -0.36 -0.00 0.00 0.00 175.17 175.10 1t5r s PHE 35 N 1.43 3.43 -0.39 4.23 0.40 0.57 -0.87 117.98 126.78 1t5r s PHE 35 Ca 0.00 0.91 -0.17 0.00 -0.60 0.00 0.00 56.93 57.08 1t5r s PHE 35 Cb -0.18 -2.71 0.01 0.00 0.51 0.00 0.00 43.02 40.65 1t5r s PHE 35 CO 0.02 -0.04 0.43 0.08 0.70 0.00 0.00 175.22 176.40 1t5r s VAL 36 N 1.40 5.10 -0.36 -0.44 1.01 0.03 -1.32 120.40 125.82 1t5r s VAL 36 Ca 0.28 -0.17 -0.10 0.00 0.00 0.00 0.00 61.98 61.98 1t5r s VAL 36 Cb -0.16 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.27 1t5r s VAL 36 CO 0.11 -0.32 0.19 -0.54 0.00 0.00 0.00 175.10 174.54 1t5r s LYS 37 N 2.15 2.88 -0.13 2.72 -0.14 -0.39 -3.68 119.74 123.15 1t5r s LYS 37 Ca 0.13 -1.04 -0.04 0.00 -1.36 0.00 0.00 55.97 53.66 1t5r s LYS 37 Cb -0.17 -3.69 0.06 0.00 -1.68 0.00 0.00 37.83 32.36 1t5r s LYS 37 CO 0.13 -0.66 0.14 0.34 -0.76 0.00 0.00 175.35 174.55 1t5r s ASP 38 N 1.55 1.44 0.64 2.83 3.68 -1.26 -0.86 116.67 124.68 1t5r s ASP 38 Ca 0.02 -0.12 0.41 0.00 2.13 0.00 0.00 52.55 54.99 1t5r s ASP 38 Cb -0.19 0.09 2.17 0.00 -1.45 0.00 0.00 42.92 43.54 1t5r s ASP 38 CO 0.06 -0.30 2.29 0.07 0.13 0.00 0.00 175.17 177.43 1t5r h LYS 39 N 8.38 0.00 -0.07 4.34 5.09 -1.87 0.71 116.57 133.14 1t5r h LYS 39 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.60 1t5r h LYS 39 Cb 1.14 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.47 1t5r h LYS 39 CO 0.22 0.01 0.00 0.36 -2.09 0.00 0.00 179.45 177.95 1t5r n LYS 40 N -3.18 1.27 -3.96 0.07 2.85 -1.26 -4.68 118.16 109.27 1t5r n LYS 40 Ca -0.02 -0.41 -0.26 0.00 -1.05 0.00 0.00 58.31 56.57 1t5r n LYS 40 Cb 0.12 -1.31 -0.17 0.00 -0.65 0.00 0.00 35.03 33.02 1t5r n LYS 40 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 177.40 176.88 1t5r s TYR 41 N -1.91 1.33 -2.00 5.58 5.04 0.24 -4.04 117.35 121.59 1t5r s TYR 41 Ca 0.27 -0.62 0.08 0.00 -2.44 0.00 0.00 57.07 54.36 1t5r s TYR 41 Cb 0.13 -1.13 0.45 0.00 0.35 0.00 0.00 41.96 41.76 1t5r s TYR 41 CO 0.21 -0.45 1.09 0.27 -1.34 0.00 0.00 175.55 175.33 1t5r n ASN 42 N 4.83 0.00 -4.26 4.32 2.04 -1.26 -4.73 115.26 116.19 1t5r n ASN 42 Ca -0.13 -1.28 -0.20 0.00 -0.44 0.00 0.00 54.58 52.52 1t5r n ASN 42 Cb 0.50 0.00 -0.12 0.00 -2.53 0.00 0.00 39.78 37.64 1t5r n ASN 42 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1t5r s LYS 43 N -2.00 1.08 -0.09 -3.83 1.02 -1.26 -4.39 119.74 110.26 1t5r s LYS 43 Ca 0.11 -1.23 -0.28 0.00 0.02 0.00 0.00 55.97 54.59 1t5r s LYS 43 Cb 0.05 -1.10 -0.02 0.00 -0.52 0.00 0.00 37.83 36.24 1t5r s LYS 43 CO 0.09 0.23 0.95 -0.51 -0.92 0.00 0.00 175.35 175.19 1t5r s ASP 44 N -2.30 7.20 0.05 2.83 -0.00 0.62 -4.85 116.67 120.22 1t5r s ASP 44 Ca 0.09 1.47 0.09 0.00 -0.00 0.00 0.00 52.55 54.20 1t5r s ASP 44 Cb -0.07 -2.53 -0.03 0.00 -0.00 0.00 0.00 42.92 40.29 1t5r s ASP 44 CO 0.04 -0.38 -0.26 0.00 -0.00 0.00 0.00 175.17 174.56 1t5r s ALA 45 N 1.78 2.27 -0.04 5.23 0.00 -1.24 0.12 121.76 129.87 1t5r s ALA 45 Ca 0.47 -1.28 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 1t5r s ALA 45 Cb -0.18 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.49 1t5r s ALA 45 CO 0.19 0.54 0.02 -1.17 0.00 0.00 0.00 175.76 175.33 1t5r s LEU 46 N -1.28 0.85 -0.31 0.00 2.96 -0.29 -0.79 118.68 119.83 1t5r s LEU 46 Ca 0.12 -0.01 -0.09 0.00 -0.22 0.00 0.00 54.13 53.93 1t5r s LEU 46 Cb -0.10 -0.23 -0.00 0.00 0.50 0.00 0.00 46.19 46.36 1t5r s LEU 46 CO 0.02 -0.15 0.13 -0.63 -1.32 0.00 0.00 176.35 174.41 1t5r s ILE 47 N 1.42 4.43 -0.23 6.68 1.01 -0.05 -1.38 121.20 133.08 1t5r s ILE 47 Ca -0.04 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.02 1t5r s ILE 47 Cb -0.13 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 1t5r s ILE 47 CO -0.03 0.06 0.11 -0.76 0.00 0.00 0.00 174.94 174.33 1t5r s LEU 48 N 1.58 3.81 -0.26 2.97 1.02 0.19 -1.94 118.68 126.04 1t5r s LEU 48 Ca 0.04 -0.02 -0.05 0.00 0.02 0.00 0.00 54.13 54.12 1t5r s LEU 48 Cb -0.17 -2.01 0.00 0.00 0.02 0.00 0.00 46.19 44.03 1t5r s LEU 48 CO 0.05 0.05 0.03 -0.75 0.02 0.00 0.00 176.35 175.74 1t5r s LYS 49 N 1.15 3.17 -0.34 1.70 2.20 -0.70 -1.52 119.74 125.39 1t5r s LYS 49 Ca 0.06 -0.78 -0.13 0.00 -0.36 0.00 0.00 55.97 54.75 1t5r s LYS 49 Cb -0.14 -3.21 -0.02 0.00 -1.51 0.00 0.00 37.83 32.95 1t5r s LYS 49 CO 0.04 -0.35 0.24 -1.64 -0.36 0.00 0.00 175.35 173.28 1t5r s MET 50 N 1.48 3.47 0.40 4.03 -1.94 0.18 -1.07 119.30 125.85 1t5r s MET 50 Ca 0.03 -0.66 0.05 0.00 -1.71 0.00 0.00 55.69 53.40 1t5r s MET 50 Cb -0.16 -3.81 -0.02 0.00 2.01 0.00 0.00 34.83 32.85 1t5r s MET 50 CO 0.00 -0.46 0.19 -0.65 -0.01 0.00 0.00 175.02 174.09 1t5r s GLN 51 N 1.72 1.94 0.00 2.03 -0.21 -0.48 -1.41 119.66 123.26 1t5r s GLN 51 Ca 0.06 -2.19 0.00 0.00 0.02 0.00 0.00 55.36 53.25 1t5r s GLN 51 Cb -0.17 -0.31 0.00 0.00 1.00 0.00 0.00 33.01 33.53 1t5r s GLN 51 CO 0.10 -0.58 0.00 0.41 -2.12 0.00 0.00 175.29 173.11 1t5r n GLY 52 N -0.88 0.62 3.33 3.09 0.00 -1.25 -0.22 105.19 109.88 1t5r n GLY 52 Ca -0.02 -1.57 -0.14 0.00 0.00 0.00 0.00 46.02 44.29 1t5r n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1t5r s PHE 53 N -3.57 -0.41 -0.17 1.61 5.36 -0.36 -4.00 117.98 116.44 1t5r s PHE 53 Ca 0.00 0.89 0.00 0.00 -0.96 0.00 0.00 56.93 56.86 1t5r s PHE 53 Cb 0.00 0.17 0.04 0.00 -0.34 0.00 0.00 43.02 42.89 1t5r s PHE 53 CO 0.00 -0.33 -0.10 0.42 -1.46 0.00 0.00 175.22 173.76 1t5r s ILE 54 N -0.42 1.43 0.34 3.12 1.01 -0.22 -0.53 121.20 125.93 1t5r s ILE 54 Ca -0.06 -0.76 -0.28 0.00 0.00 0.00 0.00 60.65 59.56 1t5r s ILE 54 Cb -0.03 -1.49 -0.10 0.00 0.01 0.00 0.00 42.46 40.85 1t5r s ILE 54 CO 0.03 0.24 1.21 0.20 0.00 0.00 0.00 174.94 176.62 1t5r s ASN 55 N 1.51 6.83 0.42 3.58 0.01 -0.01 -0.54 114.94 126.74 1t5r s ASN 55 Ca 0.01 2.48 0.17 0.00 -0.71 0.00 0.00 52.86 54.81 1t5r s ASN 55 Cb -0.15 -2.63 0.93 0.00 0.41 0.00 0.00 41.25 39.80 1t5r s ASN 55 CO -0.09 -0.47 1.90 0.77 -1.51 0.00 0.00 177.10 177.70 1t5r h SER 56 N 3.28 0.00 -3.22 -1.22 4.64 -1.69 -3.46 113.55 111.87 1t5r h SER 56 Ca -0.48 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.51 1t5r h SER 56 Cb 1.22 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.29 1t5r h SER 56 CO 0.65 0.28 -0.41 0.29 -0.87 0.00 0.00 176.83 176.77 1t5r n LYS 57 N -3.96 -1.91 -1.92 4.77 4.76 -1.26 -4.27 118.16 114.37 1t5r n LYS 57 Ca -0.02 0.82 -0.42 0.00 -2.87 0.00 0.00 58.31 55.82 1t5r n LYS 57 Cb 0.35 -5.42 -0.03 0.00 -1.84 0.00 0.00 35.03 28.10 1t5r n LYS 57 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1t5r s THR 58 N -2.78 3.09 0.14 -0.18 2.01 -1.26 -4.86 115.64 111.81 1t5r s THR 58 Ca 0.00 0.48 0.05 0.00 0.31 0.00 0.00 61.69 62.52 1t5r s THR 58 Cb 0.00 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 1t5r s THR 58 CO 0.00 -0.01 -0.10 0.42 -0.69 0.00 0.00 174.62 174.24 1t5r s THR 59 N 2.92 1.17 -0.02 -0.82 -4.23 -0.67 -5.00 115.64 109.00 1t5r s THR 59 Ca 0.75 -2.02 0.04 0.00 -1.18 0.00 0.00 61.69 59.29 1t5r s THR 59 Cb -0.39 -1.80 -0.01 0.00 1.34 0.00 0.00 72.50 71.64 1t5r s THR 59 CO 0.33 -0.72 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.23 1t5r s TYR 60 N -3.20 1.40 0.19 3.99 1.51 -1.26 -1.18 117.35 118.80 1t5r s TYR 60 Ca 0.16 -0.31 -0.20 0.00 -1.01 0.00 0.00 57.07 55.70 1t5r s TYR 60 Cb 0.02 -0.92 0.04 0.00 -0.11 0.00 0.00 41.96 40.99 1t5r s TYR 60 CO 0.01 -0.06 0.58 1.52 -1.11 0.00 0.00 175.55 176.49 1t5r s TYR 61 N -0.21 -0.31 0.34 2.71 -0.85 -0.82 -4.86 117.35 113.36 1t5r s TYR 61 Ca 0.03 0.00 -0.13 0.00 -0.52 0.00 0.00 57.07 56.45 1t5r s TYR 61 Cb -0.07 0.51 -0.08 0.00 0.38 0.00 0.00 41.96 42.70 1t5r s TYR 61 CO 0.00 -0.93 0.73 -0.80 -1.52 0.00 0.00 175.55 173.03 1t5r s ASN 62 N -2.83 6.67 0.33 -0.18 0.01 -1.26 0.06 114.94 117.74 1t5r s ASN 62 Ca 0.06 1.20 -0.26 0.00 -0.71 0.00 0.00 52.86 53.15 1t5r s ASN 62 Cb -0.02 -2.34 -0.10 0.00 0.41 0.00 0.00 41.25 39.20 1t5r s ASN 62 CO -0.06 -0.26 0.94 -0.47 -1.51 0.00 0.00 177.10 175.74 1t5r s TYR 63 N -2.11 3.67 0.15 2.20 5.04 -0.64 -4.84 117.35 120.82 1t5r s TYR 63 Ca 0.53 1.77 -0.34 0.00 -2.44 0.00 0.00 57.07 56.59 1t5r s TYR 63 Cb -0.10 -2.91 -0.16 0.00 0.35 0.00 0.00 41.96 39.13 1t5r s TYR 63 CO 0.23 0.19 1.17 1.17 -1.34 0.00 0.00 175.55 176.97 1t5r n LYS 64 N 0.48 1.08 -3.22 4.97 4.81 -1.26 -2.98 118.16 122.04 1t5r n LYS 64 Ca 0.02 0.39 -0.19 0.00 -0.87 0.00 0.00 58.31 57.66 1t5r n LYS 64 Cb 0.50 -1.90 -0.02 0.00 0.02 0.00 0.00 35.03 33.64 1t5r n LYS 64 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1t5r n ASN 65 N 2.08 -2.57 -3.94 3.14 3.02 -1.26 -4.95 115.26 110.79 1t5r n ASN 65 Ca 0.16 -0.22 -0.09 0.00 -0.03 0.00 0.00 54.58 54.41 1t5r n ASN 65 Cb 0.23 -2.20 -0.08 0.00 -0.61 0.00 0.00 39.78 37.12 1t5r n ASN 65 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1t5r s THR 66 N -2.68 0.15 -0.36 3.41 -1.32 -1.16 -5.05 115.64 108.63 1t5r s THR 66 Ca 0.32 -1.39 0.04 0.00 -1.21 0.00 0.00 61.69 59.45 1t5r s THR 66 Cb -0.18 -1.49 -0.01 0.00 -1.51 0.00 0.00 72.50 69.32 1t5r s THR 66 CO 0.39 -0.67 0.38 -0.90 -2.21 0.00 0.00 174.62 171.61 1t5r n ASP 67 N -0.05 0.72 -0.51 8.08 5.68 -1.26 -4.61 116.55 124.60 1t5r n ASP 67 Ca -0.13 -0.86 0.06 0.00 -0.50 0.00 0.00 54.79 53.36 1t5r n ASP 67 Cb 0.62 0.56 0.15 0.00 -1.14 0.00 0.00 41.12 41.32 1t5r n ASP 67 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1t5r n HIS 68 N -0.50 0.45 -3.74 2.11 -0.00 -1.26 -4.90 115.22 107.38 1t5r n HIS 68 Ca 0.02 -0.69 -0.24 0.00 -0.00 0.00 0.00 57.72 56.81 1t5r n HIS 68 Cb 0.09 -0.14 -0.17 0.00 -0.00 0.00 0.00 29.99 29.77 1t5r n HIS 68 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1t5r s ILE 69 N -1.82 0.32 0.31 0.61 1.01 -1.26 -1.04 121.20 119.33 1t5r s ILE 69 Ca 0.26 -0.00 0.04 0.00 0.00 0.00 0.00 60.65 60.95 1t5r s ILE 69 Cb 0.19 -0.60 -0.06 0.00 0.01 0.00 0.00 42.46 42.00 1t5r s ILE 69 CO 0.09 0.12 0.03 -0.54 0.00 0.00 0.00 174.94 174.64 1t5r s LYS 70 N 1.98 1.61 0.08 2.79 1.02 -0.61 -1.63 119.74 124.98 1t5r s LYS 70 Ca 0.04 -1.87 0.03 0.00 0.02 0.00 0.00 55.97 54.19 1t5r s LYS 70 Cb -0.13 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.23 1t5r s LYS 70 CO -0.06 -0.14 -0.10 0.00 -0.92 0.00 0.00 175.35 174.14 1t5r s ALA 71 N -3.25 0.98 -0.12 5.17 0.00 0.11 -0.81 121.76 123.85 1t5r s ALA 71 Ca 0.35 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.24 1t5r s ALA 71 Cb 0.08 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1t5r s ALA 71 CO 0.14 -0.02 -0.13 1.41 0.00 0.00 0.00 175.76 177.17 1t5r s MET 72 N -2.43 2.04 -0.30 0.00 1.75 -0.08 -1.94 119.30 118.34 1t5r s MET 72 Ca 0.01 -0.48 -0.06 0.00 -1.25 0.00 0.00 55.69 53.91 1t5r s MET 72 Cb -0.05 -1.85 0.02 0.00 2.84 0.00 0.00 34.83 35.79 1t5r s MET 72 CO 0.00 -0.16 0.08 0.50 -0.65 0.00 0.00 175.02 174.79 1t5r s ARG 73 N 1.29 2.95 0.15 4.11 3.52 -0.32 0.20 118.95 130.85 1t5r s ARG 73 Ca -0.01 -0.95 0.01 0.00 -0.13 0.00 0.00 55.73 54.65 1t5r s ARG 73 Cb -0.14 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 1t5r s ARG 73 CO -0.06 -0.50 0.00 1.67 -0.81 0.00 0.00 175.30 175.61 1t5r s TRP 74 N 1.46 1.07 -0.68 5.12 1.48 -0.39 -1.66 118.94 125.34 1t5r s TRP 74 Ca 0.01 -1.05 -0.27 0.00 -1.06 0.00 0.00 56.10 53.73 1t5r s TRP 74 Cb -0.18 -0.61 0.03 0.00 -1.16 0.00 0.00 33.47 31.55 1t5r s TRP 74 CO 0.02 -0.27 1.26 -1.25 -4.06 0.00 0.00 176.95 172.65 1t5r s PRO 75 N -3.93 3.29 0.40 3.25 0.04 -1.26 0.03 135.00 136.82 1t5r s PRO 75 Ca 0.22 -0.05 0.20 0.00 0.04 0.00 0.00 61.00 61.41 1t5r s PRO 75 Cb 0.06 -4.13 0.81 0.00 0.04 0.00 0.00 34.50 31.28 1t5r s PRO 75 CO 0.02 -2.00 1.79 0.35 0.04 0.00 0.00 177.00 177.20 1t5r h PHE 76 N 9.96 0.00 -2.43 0.56 3.04 -1.34 -3.45 116.94 123.28 1t5r h PHE 76 Ca -0.27 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.59 1t5r h PHE 76 Cb 1.05 0.00 -0.23 0.00 2.56 0.00 0.00 35.95 39.34 1t5r h PHE 76 CO 1.10 0.32 -0.08 -1.14 -2.02 0.00 0.00 178.31 176.49 1t5r s GLN 77 N -3.70 0.65 -0.10 1.11 0.74 -1.07 -0.55 119.66 116.74 1t5r s GLN 77 Ca -0.00 0.71 -0.06 0.00 0.05 0.00 0.00 55.36 56.06 1t5r s GLN 77 Cb 0.11 0.32 -0.04 0.00 1.10 0.00 0.00 33.01 34.50 1t5r s GLN 77 CO 0.67 -0.09 0.14 0.71 -0.55 0.00 0.00 175.29 176.17 1t5r s TYR 78 N 0.18 3.56 -0.15 1.67 1.51 0.42 -0.67 117.35 123.88 1t5r s TYR 78 Ca -0.01 0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 56.50 1t5r s TYR 78 Cb -0.04 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.88 1t5r s TYR 78 CO 0.01 0.70 -0.06 -0.80 -1.11 0.00 0.00 175.55 174.30 1t5r s ASN 79 N -1.19 4.60 -0.12 2.29 0.01 -0.41 -1.83 114.94 118.30 1t5r s ASN 79 Ca 0.17 -0.18 -0.01 0.00 -0.71 0.00 0.00 52.86 52.13 1t5r s ASN 79 Cb -0.12 -1.74 0.03 0.00 0.41 0.00 0.00 41.25 39.83 1t5r s ASN 79 CO 0.07 0.16 -0.04 -0.63 -1.51 0.00 0.00 177.10 175.15 1t5r s ILE 80 N 0.40 0.79 0.02 0.60 -1.09 -1.06 -1.57 121.20 119.28 1t5r s ILE 80 Ca -0.05 -0.24 -0.07 0.00 -2.23 0.00 0.00 60.65 58.06 1t5r s ILE 80 Cb -0.15 -0.92 -0.00 0.00 -1.58 0.00 0.00 42.46 39.81 1t5r s ILE 80 CO 0.03 0.24 0.13 -0.83 -1.23 0.00 0.00 174.94 173.29 1t5r s GLY 81 N 1.79 0.08 -0.05 6.18 0.00 -0.03 0.91 107.32 116.21 1t5r s GLY 81 Ca 0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 44.72 44.45 1t5r s GLY 81 CO -0.07 -0.41 0.12 -2.27 0.00 0.00 0.00 173.10 170.47 1t5r s LEU 82 N -1.66 1.26 0.16 0.66 1.98 -0.35 0.38 118.68 121.11 1t5r s LEU 82 Ca -0.11 0.25 -0.16 0.00 -2.89 0.00 0.00 54.13 51.22 1t5r s LEU 82 Cb -0.05 0.37 0.03 0.00 0.66 0.00 0.00 46.19 47.19 1t5r s LEU 82 CO -0.01 -0.08 0.44 -1.59 -1.89 0.00 0.00 176.35 173.23 1t5r s LYS 83 N 0.47 1.22 0.04 1.98 -2.85 -0.83 -1.12 119.74 118.64 1t5r s LYS 83 Ca -0.03 -0.83 -0.11 0.00 -1.00 0.00 0.00 55.97 54.00 1t5r s LYS 83 Cb -0.05 0.48 0.01 0.00 -2.06 0.00 0.00 37.83 36.21 1t5r s LYS 83 CO -0.02 -0.49 0.22 -0.08 0.10 0.00 0.00 175.35 175.08 1t5r s THR 84 N -3.85 0.10 -0.41 3.79 -1.32 -0.34 -1.22 115.64 112.40 1t5r s THR 84 Ca 0.07 -0.85 0.16 0.00 -1.21 0.00 0.00 61.69 59.87 1t5r s THR 84 Cb 0.01 -0.94 -0.22 0.00 -1.51 0.00 0.00 72.50 69.84 1t5r s THR 84 CO -0.07 -0.47 0.53 -0.46 -2.21 0.00 0.00 174.62 171.95 1t5r n ASN 85 N 0.61 0.97 -4.61 8.08 6.94 -1.26 -4.82 115.26 121.17 1t5r n ASN 85 Ca -0.19 -0.46 -0.43 0.00 -0.02 0.00 0.00 54.58 53.49 1t5r n ASN 85 Cb 0.59 1.37 -0.03 0.00 -2.36 0.00 0.00 39.78 39.35 1t5r n ASN 85 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1t5r s ASP 86 N -3.20 5.71 0.52 0.53 3.68 -1.26 -4.85 116.67 117.79 1t5r s ASP 86 Ca 0.00 1.97 0.35 0.00 2.13 0.00 0.00 52.55 57.00 1t5r s ASP 86 Cb 0.11 -2.52 1.82 0.00 -1.45 0.00 0.00 42.92 40.89 1t5r s ASP 86 CO 0.68 -1.74 2.06 1.55 0.13 0.00 0.00 175.17 177.84 1t5r h PRO 87 N 13.88 0.00 -0.03 4.34 0.13 -2.00 -1.22 132.00 147.09 1t5r h PRO 87 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1t5r h PRO 87 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1t5r h PRO 87 CO 0.96 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.82 1t5r n ASN 88 N -2.75 0.73 -4.50 1.44 3.02 -1.26 -4.82 115.26 107.13 1t5r n ASN 88 Ca -0.02 -1.36 -0.33 0.00 -0.03 0.00 0.00 54.58 52.84 1t5r n ASN 88 Cb 0.09 -0.02 -0.12 0.00 -0.61 0.00 0.00 39.78 39.12 1t5r n ASN 88 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1t5r s VAL 89 N -1.96 3.48 -0.06 2.41 1.01 -0.46 -2.49 120.40 122.32 1t5r s VAL 89 Ca 0.38 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1t5r s VAL 89 Cb 0.19 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1t5r s VAL 89 CO 0.31 0.56 -0.17 -1.81 0.00 0.00 0.00 175.10 173.99 1t5r s ASP 90 N -0.27 2.18 -0.23 3.32 -0.00 -0.96 -4.75 116.67 115.97 1t5r s ASP 90 Ca 0.03 -0.37 -0.29 0.00 -0.00 0.00 0.00 52.55 51.92 1t5r s ASP 90 Cb -0.13 -0.79 0.01 0.00 -0.00 0.00 0.00 42.92 42.01 1t5r s ASP 90 CO 0.03 0.12 1.05 -0.22 -0.00 0.00 0.00 175.17 176.14 1t5r s LEU 91 N 0.27 4.09 -0.13 1.23 2.96 0.91 -0.77 118.68 127.24 1t5r s LEU 91 Ca -0.09 1.37 0.18 0.00 -0.22 0.00 0.00 54.13 55.36 1t5r s LEU 91 Cb -0.14 -3.54 -0.25 0.00 0.50 0.00 0.00 46.19 42.76 1t5r s LEU 91 CO 0.04 -0.68 0.27 2.30 -1.32 0.00 0.00 176.35 176.96 1t5r n ILE 92 N 5.35 1.22 -3.54 6.68 -5.35 0.10 -4.83 119.36 119.00 1t5r n ILE 92 Ca 0.12 -0.79 -0.09 0.00 -0.27 0.00 0.00 62.75 61.72 1t5r n ILE 92 Cb 0.46 -0.51 -0.02 0.00 -1.74 0.00 0.00 39.64 37.84 1t5r n ILE 92 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1t5r s ASN 93 N -5.47 -0.41 -0.08 7.28 2.20 -1.04 -4.98 114.94 112.44 1t5r s ASN 93 Ca -0.08 -0.12 -0.27 0.00 -0.94 0.00 0.00 52.86 51.44 1t5r s ASN 93 Cb 0.08 0.52 0.06 0.00 -2.00 0.00 0.00 41.25 39.91 1t5r s ASN 93 CO 0.84 -0.88 0.63 -0.72 -2.94 0.00 0.00 177.10 174.03 1t5r s TYR 94 N -3.48 -0.61 -0.01 1.54 -0.85 -1.26 0.28 117.35 112.96 1t5r s TYR 94 Ca 0.05 1.12 0.02 0.00 -0.52 0.00 0.00 57.07 57.74 1t5r s TYR 94 Cb -0.02 0.34 0.00 0.00 0.38 0.00 0.00 41.96 42.66 1t5r s TYR 94 CO -0.07 -0.54 -0.06 -0.51 -1.52 0.00 0.00 175.55 172.85 1t5r s LEU 95 N -0.94 1.88 0.48 -3.49 1.02 0.07 -3.63 118.68 114.06 1t5r s LEU 95 Ca -0.09 -0.11 -0.21 0.00 0.02 0.00 0.00 54.13 53.74 1t5r s LEU 95 Cb -0.01 -0.34 -0.08 0.00 0.02 0.00 0.00 46.19 45.77 1t5r s LEU 95 CO 0.08 0.05 1.06 -2.16 0.02 0.00 0.00 176.35 175.39 1t5r s PRO 96 N 0.05 3.77 -0.13 1.29 0.04 -1.26 -2.03 135.00 136.73 1t5r s PRO 96 Ca -0.00 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 62.45 1t5r s PRO 96 Cb -0.05 -2.13 -0.24 0.00 0.04 0.00 0.00 34.50 32.12 1t5r s PRO 96 CO -0.00 -0.47 0.32 1.17 0.04 0.00 0.00 177.00 178.06 1t5r n LYS 97 N -0.91 0.72 -4.13 4.56 4.81 -1.24 -4.84 118.16 117.13 1t5r n LYS 97 Ca 0.09 0.24 -0.23 0.00 -0.87 0.00 0.00 58.31 57.54 1t5r n LYS 97 Cb 0.52 -1.69 -0.06 0.00 0.02 0.00 0.00 35.03 33.82 1t5r n LYS 97 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1t5r s ASN 98 N -6.75 4.71 0.05 3.14 -0.87 -1.26 -4.66 114.94 109.31 1t5r s ASN 98 Ca -0.21 -0.72 -0.35 0.00 -1.57 0.00 0.00 52.86 50.01 1t5r s ASN 98 Cb 0.07 -0.79 -0.14 0.00 -0.02 0.00 0.00 41.25 40.37 1t5r s ASN 98 CO 0.76 -0.23 1.59 1.17 -2.57 0.00 0.00 177.10 177.82 1t5r n LYS 99 N -1.11 1.81 -3.76 -0.60 4.81 -1.26 -4.75 118.16 113.30 1t5r n LYS 99 Ca -0.04 0.66 -0.13 0.00 -0.87 0.00 0.00 58.31 57.93 1t5r n LYS 99 Cb 0.61 -2.40 -0.13 0.00 0.02 0.00 0.00 35.03 33.13 1t5r n LYS 99 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1t5r s ILE 100 N 1.65 -0.03 0.00 3.15 2.07 -0.03 -5.01 121.20 123.00 1t5r s ILE 100 Ca 0.85 0.09 0.00 0.00 -1.41 0.00 0.00 60.65 60.18 1t5r s ILE 100 Cb -0.79 -0.31 0.00 0.00 0.13 0.00 0.00 42.46 41.49 1t5r s ILE 100 CO 0.45 0.04 0.79 -0.90 -1.91 0.00 0.00 174.94 173.41 1t5r n ASP 101 N 3.70 1.54 -4.72 4.50 3.85 -1.26 -0.96 116.55 123.20 1t5r n ASP 101 Ca -0.20 -1.59 -0.40 0.00 -0.71 0.00 0.00 54.79 51.88 1t5r n ASP 101 Cb 0.55 0.00 0.02 0.00 -1.35 0.00 0.00 41.12 40.34 1t5r n ASP 101 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 1t5r n SER 102 N -0.30 2.67 -0.25 -1.12 3.41 -1.26 -4.87 113.62 111.91 1t5r n SER 102 Ca 0.00 1.08 0.05 0.00 -0.26 0.00 0.00 58.87 59.74 1t5r n SER 102 Cb 0.17 -1.53 0.17 0.00 -0.26 0.00 0.00 64.21 62.76 1t5r n SER 102 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1t5r h VAL 103 N 1.98 0.41 -3.71 -3.33 2.07 -1.93 -3.39 116.25 108.35 1t5r h VAL 103 Ca -0.49 -0.05 -0.67 0.00 0.82 0.00 0.00 66.70 66.30 1t5r h VAL 103 Cb 1.29 0.24 -0.18 0.00 -1.52 0.00 0.00 31.29 31.12 1t5r h VAL 103 CO 0.59 0.03 -0.76 0.21 0.02 0.00 0.00 177.57 177.67 1t5r s ASN 104 N -5.20 4.22 -0.27 0.57 3.84 -1.26 -0.74 114.94 116.10 1t5r s ASN 104 Ca -0.13 -0.36 0.02 0.00 0.21 0.00 0.00 52.86 52.59 1t5r s ASN 104 Cb 0.22 -0.79 0.07 0.00 -0.55 0.00 0.00 41.25 40.20 1t5r s ASN 104 CO 0.75 0.22 -0.04 -0.69 -2.79 0.00 0.00 177.10 174.56 1t5r s VAL 105 N -1.08 1.85 -0.09 -5.21 1.01 -0.25 -4.99 120.40 111.64 1t5r s VAL 105 Ca 0.18 -1.61 0.01 0.00 0.00 0.00 0.00 61.98 60.56 1t5r s VAL 105 Cb -0.11 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1t5r s VAL 105 CO 0.10 -0.23 -0.08 -0.44 0.00 0.00 0.00 175.10 174.45 1t5r s SER 106 N 1.21 1.88 0.17 3.32 0.01 -1.26 -2.17 113.70 116.86 1t5r s SER 106 Ca -0.02 -0.27 -0.07 0.00 1.31 0.00 0.00 55.95 56.90 1t5r s SER 106 Cb -0.19 -0.77 -0.02 0.00 0.21 0.00 0.00 66.02 65.25 1t5r s SER 106 CO -0.08 -0.07 0.24 -1.10 0.41 0.00 0.00 173.24 172.64 1t5r s GLN 107 N 1.31 1.14 0.03 12.44 -0.21 -1.07 -5.01 119.66 128.30 1t5r s GLN 107 Ca -0.03 -1.27 0.04 0.00 0.02 0.00 0.00 55.36 54.13 1t5r s GLN 107 Cb -0.14 0.35 -0.02 0.00 1.00 0.00 0.00 33.01 34.20 1t5r s GLN 107 CO -0.03 -0.40 -0.13 0.99 -2.12 0.00 0.00 175.29 173.60 1t5r s THR 108 N -4.00 1.01 -0.28 -0.19 2.01 -1.26 -1.73 115.64 111.20 1t5r s THR 108 Ca 0.21 -0.92 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 1t5r s THR 108 Cb 0.04 -0.92 0.01 0.00 0.01 0.00 0.00 72.50 71.64 1t5r s THR 108 CO 0.02 0.00 0.04 -0.22 -0.69 0.00 0.00 174.62 173.77 1t5r s LEU 109 N -1.04 3.61 -0.04 4.42 0.20 0.17 -4.18 118.68 121.82 1t5r s LEU 109 Ca 0.01 -0.72 -0.00 0.00 0.69 0.00 0.00 54.13 54.11 1t5r s LEU 109 Cb -0.07 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.83 1t5r s LEU 109 CO 0.01 -0.16 0.01 -0.83 -0.29 0.00 0.00 176.35 175.09 1t5r s GLY 110 N 1.46 1.89 -0.02 7.98 0.00 0.17 -1.26 107.32 117.53 1t5r s GLY 110 Ca 0.02 -0.87 0.07 0.00 0.00 0.00 0.00 44.72 43.94 1t5r s GLY 110 CO 0.00 -0.69 -0.22 -0.47 0.00 0.00 0.00 173.10 171.72 1t5r s TYR 111 N -1.01 2.05 -0.04 1.90 5.04 0.19 0.73 117.35 126.21 1t5r s TYR 111 Ca 0.17 -0.43 0.04 0.00 -2.44 0.00 0.00 57.07 54.41 1t5r s TYR 111 Cb -0.11 -1.33 -0.00 0.00 0.35 0.00 0.00 41.96 40.86 1t5r s TYR 111 CO 0.07 -0.07 -0.15 -0.80 -1.34 0.00 0.00 175.55 173.26 1t5r s ASN 112 N -0.44 1.94 0.17 4.32 -0.87 0.56 -0.43 114.94 120.18 1t5r s ASN 112 Ca 0.06 -0.31 -0.27 0.00 -1.57 0.00 0.00 52.86 50.76 1t5r s ASN 112 Cb -0.10 -0.51 -0.16 0.00 -0.02 0.00 0.00 41.25 40.46 1t5r s ASN 112 CO -0.00 0.14 0.54 -0.38 -2.57 0.00 0.00 177.10 174.83 1t5r n ILE 113 N 3.14 1.66 0.00 0.60 2.08 -1.26 -1.82 119.36 123.76 1t5r n ILE 113 Ca -0.18 -0.41 0.00 0.00 0.56 0.00 0.00 62.75 62.72 1t5r n ILE 113 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.42 1t5r n ILE 113 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1t5r n GLY 114 N 1.81 1.00 2.18 7.39 0.00 -1.26 -4.49 105.19 111.83 1t5r n GLY 114 Ca 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1t5r n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t5r n GLY 115 N -1.99 0.32 3.33 -0.02 0.00 -1.21 -4.75 105.19 100.87 1t5r n GLY 115 Ca 0.00 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 1t5r n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1t5r s ASN 116 N -3.23 4.78 -0.05 1.61 0.01 -0.75 -5.00 114.94 112.30 1t5r s ASN 116 Ca 0.16 -0.58 0.01 0.00 -0.71 0.00 0.00 52.86 51.74 1t5r s ASN 116 Cb -0.07 -1.81 -0.03 0.00 0.41 0.00 0.00 41.25 39.74 1t5r s ASN 116 CO 0.27 -0.11 -0.03 -0.36 -1.51 0.00 0.00 177.10 175.36 1t5r s PHE 117 N 1.48 3.02 -0.01 2.20 0.40 -1.26 -0.33 117.98 123.49 1t5r s PHE 117 Ca 0.04 0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.48 1t5r s PHE 117 Cb -0.16 -1.71 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 1t5r s PHE 117 CO -0.00 0.40 -0.15 1.21 0.70 0.00 0.00 175.22 177.39 1t5r s ASN 118 N -1.09 1.73 -0.62 1.36 3.84 0.22 -4.95 114.94 115.43 1t5r s ASN 118 Ca 0.15 -0.27 0.02 0.00 0.21 0.00 0.00 52.86 52.96 1t5r s ASN 118 Cb -0.11 -0.19 0.39 0.00 -0.55 0.00 0.00 41.25 40.79 1t5r s ASN 118 CO 0.05 0.18 1.51 -1.20 -2.79 0.00 0.00 177.10 174.84 1t5r n SER 119 N 2.69 5.94 0.00 -4.21 7.64 -1.26 0.43 113.62 124.84 1t5r n SER 119 Ca -0.14 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 55.97 1t5r n SER 119 Cb 0.55 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1t5r n SER 119 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1t5r n SER 128 N -0.50 0.00 -4.18 6.43 2.88 -1.26 -4.76 113.62 112.23 1t5r n SER 128 Ca 0.45 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.83 1t5r n SER 128 Cb 0.47 -0.04 -0.11 0.00 -0.75 0.00 0.00 64.21 63.78 1t5r n SER 128 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1t5r s PHE 129 N -0.22 1.15 0.22 0.66 0.08 -1.26 -4.96 117.98 113.64 1t5r s PHE 129 Ca 0.00 -0.56 0.11 0.00 0.12 0.00 0.00 56.93 56.60 1t5r s PHE 129 Cb 0.00 -0.63 0.29 0.00 -0.57 0.00 0.00 43.02 42.11 1t5r s PHE 129 CO 0.00 0.04 1.56 -0.91 -0.10 0.00 0.00 175.22 175.82 1t5r h ASN 130 N 3.85 0.00 -4.83 1.36 4.21 -1.00 -3.45 115.58 115.71 1t5r h ASN 130 Ca -0.39 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.00 1t5r h ASN 130 Cb 1.19 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 38.19 1t5r h ASN 130 CO 0.48 0.65 -0.26 -0.47 -1.29 0.00 0.00 177.43 176.53 1t5r s TYR 131 N -3.44 -0.23 0.00 1.19 5.04 -1.12 -4.61 117.35 114.19 1t5r s TYR 131 Ca -0.01 0.39 -0.06 0.00 -2.44 0.00 0.00 57.07 54.96 1t5r s TYR 131 Cb 0.12 0.11 -0.00 0.00 0.35 0.00 0.00 41.96 42.54 1t5r s TYR 131 CO 0.76 -0.37 0.11 0.45 -1.34 0.00 0.00 175.55 175.16 1t5r s SER 132 N -1.11 0.05 -0.05 4.32 0.15 -1.26 -0.64 113.70 115.16 1t5r s SER 132 Ca -0.12 -0.22 -0.04 0.00 0.70 0.00 0.00 55.95 56.28 1t5r s SER 132 Cb -0.05 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1t5r s SER 132 CO 0.04 -0.33 0.13 -1.59 1.20 0.00 0.00 173.24 172.69 1t5r s LYS 133 N -1.27 0.13 0.14 5.44 0.00 -0.39 -5.00 119.74 118.78 1t5r s LYS 133 Ca -0.14 0.22 0.05 0.00 0.00 0.00 0.00 55.97 56.11 1t5r s LYS 133 Cb -0.07 -0.00 -0.04 0.00 0.00 0.00 0.00 37.83 37.71 1t5r s LYS 133 CO 0.01 -0.06 -0.11 0.95 0.00 0.00 0.00 175.35 176.14 1t5r s THR 134 N 0.37 1.22 0.17 3.79 -4.23 -1.26 0.42 115.64 116.12 1t5r s THR 134 Ca -0.03 -1.91 0.09 0.00 -1.18 0.00 0.00 61.69 58.66 1t5r s THR 134 Cb -0.04 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 1t5r s THR 134 CO -0.02 -0.62 -0.20 0.27 -0.54 0.00 0.00 174.62 173.51 1t5r s ILE 135 N -2.84 1.97 -0.30 2.99 -4.36 -0.71 -5.01 121.20 112.94 1t5r s ILE 135 Ca 0.13 -1.92 -0.11 0.00 -0.26 0.00 0.00 60.65 58.49 1t5r s ILE 135 Cb -0.01 -1.90 0.14 0.00 1.25 0.00 0.00 42.46 41.94 1t5r s ILE 135 CO 0.02 -0.23 0.73 -0.55 0.24 0.00 0.00 174.94 175.14 1t5r s SER 136 N -2.60 -1.02 -0.00 4.36 0.15 -1.24 -2.59 113.70 110.77 1t5r s SER 136 Ca 0.16 1.40 -0.19 0.00 0.70 0.00 0.00 55.95 58.02 1t5r s SER 136 Cb -0.07 2.15 0.04 0.00 -1.71 0.00 0.00 66.02 66.43 1t5r s SER 136 CO 0.07 -0.20 0.42 -0.72 1.20 0.00 0.00 173.24 174.02 1t5r s TYR 137 N 2.78 -0.31 -0.03 3.44 -0.85 -0.92 -4.67 117.35 116.78 1t5r s TYR 137 Ca -0.05 0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 56.91 1t5r s TYR 137 Cb -0.11 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.40 1t5r s TYR 137 CO -0.19 -0.50 0.16 -0.80 -1.52 0.00 0.00 175.55 172.71 1t5r s ASN 138 N -1.51 6.30 -0.29 -0.18 0.01 -1.26 -1.09 114.94 116.91 1t5r s ASN 138 Ca -0.10 0.35 0.20 0.00 -0.71 0.00 0.00 52.86 52.59 1t5r s ASN 138 Cb -0.03 -1.97 0.48 0.00 0.41 0.00 0.00 41.25 40.14 1t5r s ASN 138 CO 0.04 0.29 1.21 0.00 -1.51 0.00 0.00 177.10 177.13 1t5r n GLN 139 N 1.17 1.58 -1.57 -0.60 10.64 0.08 -4.76 117.38 123.91 1t5r n GLN 139 Ca -0.13 -2.88 -0.58 0.00 -1.83 0.00 0.00 57.00 51.57 1t5r n GLN 139 Cb 0.53 -1.04 -0.08 0.00 -0.86 0.00 0.00 30.24 28.79 1t5r n GLN 139 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 1t5r n GLN 140 N -0.78 0.38 -0.36 2.61 7.27 -1.25 0.17 117.38 125.41 1t5r n GLN 140 Ca 0.01 0.14 0.00 0.00 0.07 0.00 0.00 57.00 57.22 1t5r n GLN 140 Cb 0.82 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 31.78 1t5r n GLN 140 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1t5r n ASN 141 N 2.38 0.00 -4.80 1.69 5.03 -1.26 -4.74 115.26 113.57 1t5r n ASN 141 Ca 0.22 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 55.41 1t5r n ASN 141 Cb 0.09 -0.31 -0.05 0.00 -1.02 0.00 0.00 39.78 38.49 1t5r n ASN 141 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1t5r s TYR 142 N -3.00 2.35 -0.01 3.10 1.51 0.13 -0.54 117.35 120.88 1t5r s TYR 142 Ca 0.00 -0.66 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 1t5r s TYR 142 Cb 0.00 -1.96 0.01 0.00 -0.11 0.00 0.00 41.96 39.90 1t5r s TYR 142 CO 0.00 -0.00 -0.02 -1.50 -1.11 0.00 0.00 175.55 172.91 1t5r s ILE 143 N -2.64 0.22 -0.11 2.71 2.07 0.13 -4.75 121.20 118.83 1t5r s ILE 143 Ca 0.38 -0.07 -0.05 0.00 -1.41 0.00 0.00 60.65 59.50 1t5r s ILE 143 Cb 0.01 -0.22 -0.04 0.00 0.13 0.00 0.00 42.46 42.34 1t5r s ILE 143 CO 0.22 0.09 0.07 -0.44 -1.91 0.00 0.00 174.94 172.96 1t5r s SER 144 N 0.22 5.78 -0.21 4.50 0.01 -0.13 -1.70 113.70 122.17 1t5r s SER 144 Ca -0.02 0.27 -0.27 0.00 1.31 0.00 0.00 55.95 57.24 1t5r s SER 144 Cb -0.05 -1.79 0.08 0.00 0.21 0.00 0.00 66.02 64.47 1t5r s SER 144 CO -0.01 0.36 0.79 -0.70 0.41 0.00 0.00 173.24 174.10 1t5r s GLU 145 N -0.76 0.81 -0.13 12.44 2.12 -0.56 -0.85 118.70 131.76 1t5r s GLU 145 Ca 0.13 0.68 -0.29 0.00 0.36 0.00 0.00 54.97 55.84 1t5r s GLU 145 Cb -0.12 0.39 -0.02 0.00 0.26 0.00 0.00 34.13 34.64 1t5r s GLU 145 CO 0.03 -0.15 1.28 0.08 -0.54 0.00 0.00 175.26 175.95 1t5r s VAL 146 N -0.15 4.20 -0.16 3.70 1.01 -1.26 -0.66 120.40 127.09 1t5r s VAL 146 Ca -0.02 1.48 0.17 0.00 0.00 0.00 0.00 61.98 63.61 1t5r s VAL 146 Cb -0.03 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1t5r s VAL 146 CO 0.02 -0.10 1.07 1.05 0.00 0.00 0.00 175.10 177.14 1t5r h GLU 147 N 8.11 0.00 -1.60 2.72 9.09 -1.00 -3.48 114.58 128.42 1t5r h GLU 147 Ca -0.29 0.00 0.06 0.00 0.05 0.00 0.00 59.36 59.18 1t5r h GLU 147 Cb 1.12 0.00 -0.25 0.00 -1.65 0.00 0.00 28.75 27.97 1t5r h GLU 147 CO 0.95 0.30 0.47 -1.58 0.05 0.00 0.00 179.01 179.20 1t5r s HIS 148 N -3.01 -0.45 -0.06 2.06 2.46 -1.20 -5.02 115.29 110.07 1t5r s HIS 148 Ca -0.00 1.02 -0.30 0.00 0.47 0.00 0.00 55.06 56.25 1t5r s HIS 148 Cb 0.08 0.39 0.09 0.00 -0.13 0.00 0.00 32.58 33.01 1t5r s HIS 148 CO 0.78 -0.27 0.77 1.14 -2.47 0.00 0.00 174.74 174.69 1t5r s GLN 149 N -0.18 0.94 0.01 2.88 1.03 -1.26 -0.99 119.66 122.09 1t5r s GLN 149 Ca 0.01 0.14 -0.00 0.00 0.04 0.00 0.00 55.36 55.55 1t5r s GLN 149 Cb -0.04 0.44 0.00 0.00 0.03 0.00 0.00 33.01 33.45 1t5r s GLN 149 CO -0.04 -0.31 0.02 0.27 -2.54 0.00 0.00 175.29 172.69 1t5r n ASN 150 N 0.70 -0.06 0.01 12.60 0.23 -0.58 -4.99 115.26 123.18 1t5r n ASN 150 Ca -0.16 -1.04 0.04 0.00 -0.53 0.00 0.00 54.58 52.89 1t5r n ASN 150 Cb 0.58 0.10 0.19 0.00 -2.08 0.00 0.00 39.78 38.56 1t5r n ASN 150 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1t5r n SER 151 N -1.17 0.02 -0.17 0.53 3.41 -1.26 -2.81 113.62 112.17 1t5r n SER 151 Ca -0.00 0.51 0.02 0.00 -0.26 0.00 0.00 58.87 59.14 1t5r n SER 151 Cb 0.02 -0.51 0.02 0.00 -0.26 0.00 0.00 64.21 63.48 1t5r n SER 151 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1t5r n LYS 152 N -1.53 0.02 -3.62 4.33 4.76 -1.26 -0.06 118.16 120.79 1t5r n LYS 152 Ca 0.02 -0.87 -0.02 0.00 -2.87 0.00 0.00 58.31 54.57 1t5r n LYS 152 Cb 0.10 -1.08 -0.01 0.00 -1.84 0.00 0.00 35.03 32.20 1t5r n LYS 152 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1t5r s SER 153 N -0.42 -0.13 -0.16 4.39 1.04 -1.12 -1.19 113.70 116.10 1t5r s SER 153 Ca 0.05 -0.13 -0.10 0.00 0.48 0.00 0.00 55.95 56.26 1t5r s SER 153 Cb 0.03 0.23 0.05 0.00 0.10 0.00 0.00 66.02 66.44 1t5r s SER 153 CO 0.05 -0.41 0.39 0.54 0.98 0.00 0.00 173.24 174.79 1t5r s VAL 154 N -2.63 -0.02 -0.11 5.02 0.11 -0.28 -1.52 120.40 120.97 1t5r s VAL 154 Ca 0.12 0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.26 1t5r s VAL 154 Cb 0.02 -0.57 0.02 0.00 -1.53 0.00 0.00 36.38 34.31 1t5r s VAL 154 CO -0.04 0.03 -0.13 -1.10 -3.33 0.00 0.00 175.10 170.54 1t5r s GLN 155 N 1.14 1.99 0.09 1.54 -0.21 -0.16 -1.21 119.66 122.83 1t5r s GLN 155 Ca -0.08 -0.47 0.01 0.00 0.02 0.00 0.00 55.36 54.85 1t5r s GLN 155 Cb -0.07 -1.77 -0.04 0.00 1.00 0.00 0.00 33.01 32.13 1t5r s GLN 155 CO -0.10 -0.12 0.20 -1.58 -2.12 0.00 0.00 175.29 171.57 1t5r s TRP 156 N 1.17 3.43 -0.10 0.91 0.51 0.26 -0.33 118.94 124.79 1t5r s TRP 156 Ca -0.04 0.17 0.02 0.00 -2.12 0.00 0.00 56.10 54.14 1t5r s TRP 156 Cb -0.14 -1.70 0.01 0.00 -0.81 0.00 0.00 33.47 30.83 1t5r s TRP 156 CO -0.04 0.56 -0.16 0.20 -0.51 0.00 0.00 176.95 177.00 1t5r s GLY 157 N -2.69 1.02 -0.44 0.98 0.00 0.17 -2.58 107.32 103.77 1t5r s GLY 157 Ca 0.34 -0.68 0.04 0.00 0.00 0.00 0.00 44.72 44.41 1t5r s GLY 157 CO 0.27 0.11 0.18 -0.42 0.00 0.00 0.00 173.10 173.24 1t5r s ILE 158 N 0.80 2.35 0.28 0.90 1.09 -0.76 -1.50 121.20 124.36 1t5r s ILE 158 Ca -0.11 -2.87 0.09 0.00 -1.10 0.00 0.00 60.65 56.66 1t5r s ILE 158 Cb -0.16 -2.67 -0.04 0.00 -1.06 0.00 0.00 42.46 38.53 1t5r s ILE 158 CO 0.01 -0.73 0.07 -1.59 -0.10 0.00 0.00 174.94 172.60 1t5r s LYS 159 N 0.23 2.44 0.10 2.79 -2.85 -0.69 -0.43 119.74 121.33 1t5r s LYS 159 Ca 0.15 -1.37 -0.32 0.00 -1.00 0.00 0.00 55.97 53.43 1t5r s LYS 159 Cb -0.23 -2.25 -0.11 0.00 -2.06 0.00 0.00 37.83 33.18 1t5r s LYS 159 CO -0.04 0.32 1.81 0.00 0.10 0.00 0.00 175.35 177.54 1t5r n ALA 160 N -1.00 1.90 0.00 0.59 0.00 0.28 -0.69 120.51 121.59 1t5r n ALA 160 Ca -0.06 0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.70 1t5r n ALA 160 Cb 0.59 -2.54 -0.00 0.00 0.00 0.00 0.00 19.45 17.49 1t5r n ALA 160 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1t5r n ASN 161 N 5.43 0.58 -3.79 0.00 5.15 0.30 -4.12 115.26 118.80 1t5r n ASN 161 Ca 0.18 0.08 -0.13 0.00 -0.60 0.00 0.00 54.58 54.12 1t5r n ASN 161 Cb 0.35 -0.29 -0.12 0.00 -0.53 0.00 0.00 39.78 39.20 1t5r n ASN 161 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1t5r s SER 162 N -5.22 -0.25 0.02 1.20 1.04 -1.09 -1.88 113.70 107.52 1t5r s SER 162 Ca -0.04 0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1t5r s SER 162 Cb 0.01 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1t5r s SER 162 CO 0.06 -0.08 0.00 0.49 0.98 0.00 0.00 173.24 174.68 1t5r n PHE 163 N 2.97 -0.10 -4.55 5.02 3.01 -1.26 -4.51 117.46 118.04 1t5r n PHE 163 Ca -0.13 0.02 -0.33 0.00 1.01 0.00 0.00 57.45 58.02 1t5r n PHE 163 Cb 0.58 0.19 -0.16 0.00 -0.01 0.00 0.00 39.48 40.09 1t5r n PHE 163 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1t5r s LYS 169 N -2.00 3.15 0.05 -1.08 2.36 -1.26 -4.81 119.74 116.15 1t5r s LYS 169 Ca 0.00 -0.78 -0.02 0.00 -2.55 0.00 0.00 55.97 52.62 1t5r s LYS 169 Cb 0.00 -2.57 -0.03 0.00 -1.05 0.00 0.00 37.83 34.18 1t5r s LYS 169 CO 0.00 -0.00 -0.00 0.00 1.55 0.00 0.00 175.35 176.89 1t5r s MET 170 N 0.84 0.62 0.88 4.03 0.00 -1.26 -5.16 119.30 119.24 1t5r s MET 170 Ca -0.05 -1.15 -0.13 0.00 0.00 0.00 0.00 55.69 54.36 1t5r s MET 170 Cb -0.15 0.22 0.12 0.00 0.00 0.00 0.00 34.83 35.02 1t5r s MET 170 CO -0.01 -0.12 1.18 -1.54 0.00 0.00 0.00 175.02 174.52 1t5r s SER 171 N -2.82 3.80 0.00 -1.18 1.04 -1.26 -4.42 113.70 108.86 1t5r s SER 171 Ca 0.05 0.79 0.22 0.00 0.48 0.00 0.00 55.95 57.49 1t5r s SER 171 Cb 0.06 -1.26 1.16 0.00 0.10 0.00 0.00 66.02 66.08 1t5r s SER 171 CO -0.09 -2.35 1.70 0.61 0.98 0.00 0.00 173.24 174.09 1t5r n GLY 172 N -2.82 -0.92 0.75 7.32 0.00 -0.79 -2.19 105.19 106.54 1t5r n GLY 172 Ca 0.08 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.08 1t5r n GLY 172 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1t5r n HIS 173 N -1.21 0.09 -2.10 1.61 8.25 -1.26 -4.94 115.22 115.66 1t5r n HIS 173 Ca 0.12 -0.06 -0.42 0.00 -0.26 0.00 0.00 57.72 57.10 1t5r n HIS 173 Cb 0.15 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 1t5r n HIS 173 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1t5r s ASP 174 N -1.42 6.72 0.58 0.41 -1.08 -0.93 -4.89 116.67 116.06 1t5r s ASP 174 Ca 0.23 2.09 0.28 0.00 -0.52 0.00 0.00 52.55 54.63 1t5r s ASP 174 Cb 0.15 -2.53 1.63 0.00 -1.46 0.00 0.00 42.92 40.71 1t5r s ASP 174 CO 0.23 -0.90 2.10 1.55 0.52 0.00 0.00 175.17 178.66 1t5r h PRO 175 N 9.29 0.00 -0.22 4.34 0.13 -1.91 -0.88 132.00 142.76 1t5r h PRO 175 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1t5r h PRO 175 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1t5r h PRO 175 CO 0.96 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.82 1t5r n ASN 176 N -3.85 2.03 -4.69 1.44 3.02 -1.26 -3.66 115.26 108.29 1t5r n ASN 176 Ca 0.02 -1.78 -0.44 0.00 -0.03 0.00 0.00 54.58 52.35 1t5r n ASN 176 Cb 0.33 -0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.34 1t5r n ASN 176 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1t5r n LEU 177 N 0.57 3.47 0.00 3.41 7.94 -0.34 -1.92 117.00 130.12 1t5r n LEU 177 Ca 0.16 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.22 1t5r n LEU 177 Cb 0.38 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.86 1t5r n LEU 177 CO 0.13 -0.35 0.00 0.49 -1.11 0.00 0.00 177.39 176.55 1t5r n PHE 178 N 1.62 0.00 -2.05 1.96 3.72 -1.26 -4.97 117.46 116.48 1t5r n PHE 178 Ca 0.09 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.08 1t5r n PHE 178 Cb 0.34 -1.35 -0.03 0.00 -0.94 0.00 0.00 39.48 37.50 1t5r n PHE 178 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1t5r s VAL 179 N -1.45 2.80 0.00 -4.37 1.01 -0.81 -1.87 120.40 115.71 1t5r s VAL 179 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1t5r s VAL 179 Cb 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1t5r s VAL 179 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1t5r n GLY 180 N 2.62 -0.95 0.00 4.51 0.00 0.35 -4.21 105.19 107.51 1t5r n GLY 180 Ca 0.08 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1t5r n GLY 180 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1t5r n TYR 181 N -0.13 0.00 -3.44 1.61 4.02 -1.26 -4.69 117.16 113.28 1t5r n TYR 181 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 1t5r n TYR 181 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 1t5r n TYR 181 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1t5r n LYS 182 N -0.23 3.18 0.01 -0.72 5.02 -1.23 -4.92 118.16 119.27 1t5r n LYS 182 Ca 0.00 -4.50 0.00 0.00 -2.02 0.00 0.00 58.31 51.79 1t5r n LYS 182 Cb 0.07 -2.46 0.03 0.00 -0.02 0.00 0.00 35.03 32.65 1t5r n LYS 182 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1t5r n PRO 183 N 2.15 0.01 -0.00 1.97 -0.04 -1.26 -2.20 135.00 135.63 1t5r n PRO 183 Ca 0.24 0.49 0.01 0.00 -0.04 0.00 0.00 63.50 64.20 1t5r n PRO 183 Cb 0.37 -1.53 0.01 0.00 -0.04 0.00 0.00 33.50 32.30 1t5r n PRO 183 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1t5r n TYR 184 N -1.52 0.00 -1.82 0.54 4.01 -1.26 -4.87 117.16 112.23 1t5r n TYR 184 Ca -0.00 -0.01 -0.35 0.00 -0.16 0.00 0.00 57.90 57.38 1t5r n TYR 184 Cb 0.02 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.09 1t5r n TYR 184 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1t5r s SER 185 N -0.15 4.95 0.00 7.72 0.15 -0.93 -4.92 113.70 120.52 1t5r s SER 185 Ca 0.02 2.28 0.24 0.00 0.70 0.00 0.00 55.95 59.18 1t5r s SER 185 Cb 0.01 -2.58 0.24 0.00 -1.71 0.00 0.00 66.02 61.98 1t5r s SER 185 CO 0.02 -1.75 1.25 0.00 1.20 0.00 0.00 173.24 173.96 1t5r n GLN 186 N -2.05 1.37 -3.28 5.44 6.02 -1.26 -4.85 117.38 118.77 1t5r n GLN 186 Ca 0.13 -1.07 -0.40 0.00 -0.01 0.00 0.00 57.00 55.64 1t5r n GLN 186 Cb 0.50 -1.48 -0.08 0.00 1.02 0.00 0.00 30.24 30.21 1t5r n GLN 186 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1t5r s ASN 187 N -2.37 6.33 0.52 1.08 3.84 -1.26 -4.95 114.94 118.13 1t5r s ASN 187 Ca 0.23 0.22 0.22 0.00 0.21 0.00 0.00 52.86 53.74 1t5r s ASN 187 Cb 0.19 -2.26 1.33 0.00 -0.55 0.00 0.00 41.25 39.96 1t5r s ASN 187 CO 0.50 -0.34 2.02 1.55 -2.79 0.00 0.00 177.10 178.04 1t5r h PRO 188 N 8.25 0.05 -0.59 0.43 0.13 -1.88 0.25 132.00 138.64 1t5r h PRO 188 Ca -0.29 -0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1t5r h PRO 188 Cb 1.14 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1t5r h PRO 188 CO 0.72 0.04 0.39 -0.09 -0.23 0.00 0.00 178.00 178.83 1t5r h ARG 189 N 0.06 0.78 0.00 0.86 9.65 -1.91 -1.62 114.38 122.20 1t5r h ARG 189 Ca 0.21 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1t5r h ARG 189 Cb 0.78 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.19 1t5r h ARG 189 CO -0.01 0.52 0.00 -0.25 2.80 0.00 0.00 179.97 183.02 1t5r n ASP 190 N -4.45 0.05 -0.05 -3.80 8.00 0.08 -2.17 116.55 114.22 1t5r n ASP 190 Ca 0.06 0.51 0.15 0.00 0.71 0.00 0.00 54.79 56.22 1t5r n ASP 190 Cb 0.04 -0.52 0.76 0.00 -0.02 0.00 0.00 41.12 41.38 1t5r n ASP 190 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1t5r n TYR 191 N -1.55 0.00 -4.15 1.24 4.02 -0.61 -3.47 117.16 112.64 1t5r n TYR 191 Ca 0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.79 1t5r n TYR 191 Cb 0.17 -0.18 -0.11 0.00 -0.02 0.00 0.00 39.34 39.20 1t5r n TYR 191 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1t5r s PHE 192 N -2.38 0.96 0.51 -0.72 0.40 -0.92 0.13 117.98 115.96 1t5r s PHE 192 Ca 0.34 -0.65 -0.20 0.00 -0.60 0.00 0.00 56.93 55.82 1t5r s PHE 192 Cb 0.21 -0.54 -0.10 0.00 0.51 0.00 0.00 43.02 43.10 1t5r s PHE 192 CO 0.44 -0.04 0.57 1.33 0.70 0.00 0.00 175.22 178.22 1t5r n VAL 193 N 0.70 2.13 -2.02 -0.44 0.24 -0.78 -4.53 118.33 113.62 1t5r n VAL 193 Ca -0.17 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.34 61.30 1t5r n VAL 193 Cb 0.57 -0.68 0.02 0.00 -1.47 0.00 0.00 33.84 32.28 1t5r n VAL 193 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1t5r s PRO 194 N -1.93 3.21 0.26 7.34 0.04 -1.26 -4.89 135.00 137.77 1t5r s PRO 194 Ca 0.67 1.30 -0.04 0.00 0.04 0.00 0.00 61.00 62.97 1t5r s PRO 194 Cb -0.50 -2.01 0.53 0.00 0.04 0.00 0.00 34.50 32.57 1t5r s PRO 194 CO 0.56 -0.91 1.63 -0.44 0.04 0.00 0.00 177.00 177.87 1t5r h ASP 195 N 0.46 -0.30 0.00 6.66 3.45 -1.93 0.45 116.42 125.21 1t5r h ASP 195 Ca -0.47 0.21 0.00 0.00 0.43 0.00 0.00 57.03 57.20 1t5r h ASP 195 Cb 1.23 0.35 0.00 0.00 -0.56 0.00 0.00 39.33 40.35 1t5r h ASP 195 CO 0.57 -0.20 0.08 -0.46 -1.57 0.00 0.00 179.24 177.66 1t5r n ASN 196 N -5.34 0.00 -0.53 6.45 0.23 -1.26 0.81 115.26 115.62 1t5r n ASN 196 Ca 0.16 0.42 0.07 0.00 -0.53 0.00 0.00 54.58 54.70 1t5r n ASN 196 Cb 0.55 -0.42 0.05 0.00 -2.08 0.00 0.00 39.78 37.89 1t5r n ASN 196 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1t5r n GLU 197 N -1.42 0.92 -4.07 -3.83 1.02 0.16 -4.99 120.64 108.43 1t5r n GLU 197 Ca 0.00 -1.27 -0.32 0.00 -0.02 0.00 0.00 57.16 55.55 1t5r n GLU 197 Cb 0.08 -1.25 -0.07 0.00 -0.02 0.00 0.00 31.44 30.18 1t5r n GLU 197 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1t5r s LEU 198 N -1.16 3.89 0.58 -4.62 1.43 0.24 -4.97 118.68 114.07 1t5r s LEU 198 Ca 0.15 0.09 -0.16 0.00 -1.03 0.00 0.00 54.13 53.19 1t5r s LEU 198 Cb 0.11 -2.40 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 1t5r s LEU 198 CO 0.18 0.23 1.04 -2.16 0.23 0.00 0.00 176.35 175.86 1t5r s PRO 199 N -2.05 3.45 0.43 1.29 0.04 -1.26 -4.81 135.00 132.09 1t5r s PRO 199 Ca 0.26 1.12 0.20 0.00 0.04 0.00 0.00 61.00 62.62 1t5r s PRO 199 Cb -0.12 -2.05 1.14 0.00 0.04 0.00 0.00 34.50 33.51 1t5r s PRO 199 CO 0.18 -0.70 1.83 -1.35 0.04 0.00 0.00 177.00 177.01 1t5r h PRO 200 N 0.47 0.34 0.00 0.56 0.11 -1.91 -0.50 132.00 131.07 1t5r h PRO 200 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1t5r h PRO 200 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1t5r h PRO 200 CO 0.58 0.23 0.00 1.28 -0.21 0.00 0.00 178.00 179.88 1t5r n LEU 201 N -4.50 0.15 -0.11 2.35 4.77 -1.25 -1.10 117.00 117.31 1t5r n LEU 201 Ca 0.21 0.54 -0.24 0.00 -0.03 0.00 0.00 56.01 56.50 1t5r n LEU 201 Cb 0.79 -0.53 -0.08 0.00 -2.33 0.00 0.00 43.42 41.28 1t5r n LEU 201 CO 0.30 -0.37 -1.24 0.52 -1.33 0.00 0.00 177.39 175.28 1t5r n VAL 202 N -1.68 1.31 0.42 4.08 0.31 -0.22 -4.28 118.33 118.27 1t5r n VAL 202 Ca 0.03 -0.28 0.12 0.00 -0.01 0.00 0.00 64.34 64.20 1t5r n VAL 202 Cb 0.16 -1.86 0.27 0.00 -0.91 0.00 0.00 33.84 31.49 1t5r n VAL 202 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 1t5r h HIS 203 N -0.84 0.00 0.00 3.52 2.07 -1.54 -3.41 115.15 114.95 1t5r h HIS 203 Ca -0.54 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 56.98 1t5r h HIS 203 Cb 1.46 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.44 1t5r h HIS 203 CO -0.10 0.00 0.00 0.45 -3.07 0.00 0.00 177.93 175.21 1t5r n SER 204 N -2.64 0.33 0.00 3.10 2.88 -0.26 -4.93 113.62 112.11 1t5r n SER 204 Ca 0.04 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 1t5r n SER 204 Cb 0.48 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 1t5r n SER 204 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1t5r n GLY 205 N 3.30 -1.10 3.32 0.46 0.00 -0.26 -1.98 105.19 108.93 1t5r n GLY 205 Ca 0.00 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 1t5r n GLY 205 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1t5r s PHE 206 N -2.96 2.45 -0.86 1.61 5.36 0.30 -3.80 117.98 120.08 1t5r s PHE 206 Ca 0.00 -0.51 -0.02 0.00 -0.96 0.00 0.00 56.93 55.44 1t5r s PHE 206 Cb 0.00 -1.57 0.21 0.00 -0.34 0.00 0.00 43.02 41.32 1t5r s PHE 206 CO 0.00 -0.07 0.74 -0.80 -1.46 0.00 0.00 175.22 173.63 1t5r s ASN 207 N -0.43 5.95 0.53 6.13 0.01 -1.26 -1.06 114.94 124.81 1t5r s ASN 207 Ca 0.04 -3.57 -0.22 0.00 -0.71 0.00 0.00 52.86 48.40 1t5r s ASN 207 Cb -0.12 -1.92 -0.05 0.00 0.41 0.00 0.00 41.25 39.57 1t5r s ASN 207 CO 0.01 -0.22 1.35 -2.16 -1.51 0.00 0.00 177.10 174.57 1t5r s PRO 208 N -1.13 3.24 -0.36 -0.60 0.04 -1.26 -4.63 135.00 130.31 1t5r s PRO 208 Ca 0.26 2.21 0.03 0.00 0.04 0.00 0.00 61.00 63.54 1t5r s PRO 208 Cb -0.09 -2.30 0.16 0.00 0.04 0.00 0.00 34.50 32.30 1t5r s PRO 208 CO -0.11 -1.10 0.41 0.45 0.04 0.00 0.00 177.00 176.69 1t5r s SER 209 N -0.95 0.75 0.10 6.66 0.15 -1.21 -3.75 113.70 115.45 1t5r s SER 209 Ca 0.70 -1.25 0.05 0.00 0.70 0.00 0.00 55.95 56.15 1t5r s SER 209 Cb -0.40 0.81 -0.03 0.00 -1.71 0.00 0.00 66.02 64.69 1t5r s SER 209 CO 0.47 -0.27 -0.13 -0.36 1.20 0.00 0.00 173.24 174.15 1t5r s PHE 210 N 1.71 1.22 0.03 3.44 0.08 -0.50 -4.42 117.98 119.55 1t5r s PHE 210 Ca 0.15 -0.55 0.05 0.00 0.12 0.00 0.00 56.93 56.70 1t5r s PHE 210 Cb -0.13 -0.66 -0.02 0.00 -0.57 0.00 0.00 43.02 41.63 1t5r s PHE 210 CO -0.10 0.07 -0.13 0.42 -0.10 0.00 0.00 175.22 175.38 1t5r s ILE 211 N -1.92 1.06 -0.07 0.64 1.01 -0.86 0.47 121.20 121.52 1t5r s ILE 211 Ca 0.04 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 1t5r s ILE 211 Cb -0.06 -0.96 0.03 0.00 0.01 0.00 0.00 42.46 41.48 1t5r s ILE 211 CO 0.02 0.02 0.17 0.00 0.00 0.00 0.00 174.94 175.15 1t5r s ALA 212 N -0.79 -0.39 -0.12 9.38 0.00 -0.58 -0.75 121.76 128.51 1t5r s ALA 212 Ca 0.01 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.61 1t5r s ALA 212 Cb -0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 1t5r s ALA 212 CO 0.01 -0.12 -0.19 0.99 0.00 0.00 0.00 175.76 176.45 1t5r s THR 213 N 0.60 2.50 0.21 0.00 2.01 0.14 -0.63 115.64 120.47 1t5r s THR 213 Ca -0.04 -0.85 0.10 0.00 0.31 0.00 0.00 61.69 61.20 1t5r s THR 213 Cb -0.06 -2.01 -0.05 0.00 0.01 0.00 0.00 72.50 70.40 1t5r s THR 213 CO -0.03 0.54 -0.19 0.68 -0.69 0.00 0.00 174.62 174.93 1t5r s VAL 214 N 0.43 2.09 0.35 3.82 -7.23 -0.48 0.02 120.40 119.40 1t5r s VAL 214 Ca -0.14 -2.14 0.09 0.00 -1.81 0.00 0.00 61.98 57.98 1t5r s VAL 214 Cb -0.17 -2.07 -0.06 0.00 0.56 0.00 0.00 36.38 34.64 1t5r s VAL 214 CO 0.06 -0.36 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.49 1t5r s SER 215 N -3.04 3.83 -0.16 4.85 1.04 0.05 -1.14 113.70 119.13 1t5r s SER 215 Ca 0.22 -1.18 -0.07 0.00 0.48 0.00 0.00 55.95 55.40 1t5r s SER 215 Cb -0.05 -0.39 0.07 0.00 0.10 0.00 0.00 66.02 65.75 1t5r s SER 215 CO 0.10 -0.24 0.36 -2.28 0.98 0.00 0.00 173.24 172.16 1t5r s HIS 216 N -2.61 -0.60 -0.19 5.02 5.04 0.32 -2.26 115.29 120.01 1t5r s HIS 216 Ca 0.33 1.24 -0.29 0.00 -1.54 0.00 0.00 55.06 54.81 1t5r s HIS 216 Cb 0.03 0.19 -0.05 0.00 0.04 0.00 0.00 32.58 32.79 1t5r s HIS 216 CO 0.17 -0.38 2.05 -1.83 -2.34 0.00 0.00 174.74 172.41 1t5r s GLU 217 N 1.99 3.40 0.38 2.88 1.03 -1.04 -0.28 118.70 127.06 1t5r s GLU 217 Ca -0.05 2.00 -0.26 0.00 0.03 0.00 0.00 54.97 56.69 1t5r s GLU 217 Cb -0.11 -4.28 -0.11 0.00 -0.80 0.00 0.00 34.13 28.83 1t5r s GLU 217 CO -0.11 -1.79 1.08 1.63 -1.33 0.00 0.00 175.26 174.74 1t5r n LYS 218 N 8.39 1.54 -1.01 -4.83 5.02 -1.26 -2.35 118.16 123.66 1t5r n LYS 218 Ca 0.26 0.55 -0.01 0.00 -2.02 0.00 0.00 58.31 57.09 1t5r n LYS 218 Cb 0.45 -2.08 -0.00 0.00 -0.02 0.00 0.00 35.03 33.37 1t5r n LYS 218 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t5r n GLY 219 N 1.08 0.30 0.06 0.72 0.00 -1.26 -4.84 105.19 101.26 1t5r n GLY 219 Ca 0.08 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1t5r n GLY 219 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t5r n SER 220 N -0.45 0.61 0.00 1.61 3.41 -0.99 -4.99 113.62 112.82 1t5r n SER 220 Ca -0.01 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1t5r n SER 220 Cb 0.25 0.81 0.00 0.00 -0.26 0.00 0.00 64.21 65.01 1t5r n SER 220 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t5r n GLY 221 N 1.27 2.40 0.01 5.00 0.00 -1.26 -5.04 105.19 107.57 1t5r n GLY 221 Ca 0.00 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.65 1t5r n GLY 221 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1t5r n ASP 222 N 0.00 0.65 -4.13 1.61 9.92 -1.26 -4.83 116.55 118.51 1t5r n ASP 222 Ca 0.00 -0.45 -0.11 0.00 -0.53 0.00 0.00 54.79 53.70 1t5r n ASP 222 Cb 0.00 0.42 -0.10 0.00 -0.64 0.00 0.00 41.12 40.79 1t5r n ASP 222 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1t5r s THR 223 N -2.98 0.63 -0.08 -3.53 -4.23 -1.26 0.61 115.64 104.80 1t5r s THR 223 Ca 0.11 -1.67 -0.11 0.00 -1.18 0.00 0.00 61.69 58.83 1t5r s THR 223 Cb 0.17 -1.35 0.03 0.00 1.34 0.00 0.00 72.50 72.68 1t5r s THR 223 CO 0.73 -0.73 0.29 -0.44 -0.54 0.00 0.00 174.62 173.93 1t5r s SER 224 N -2.60 -0.26 -0.18 3.99 0.01 -0.92 -4.98 113.70 108.76 1t5r s SER 224 Ca 0.05 0.43 -0.07 0.00 1.31 0.00 0.00 55.95 57.67 1t5r s SER 224 Cb 0.01 0.52 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 1t5r s SER 224 CO -0.03 -0.20 0.07 -1.61 0.41 0.00 0.00 173.24 171.87 1t5r s GLU 225 N -0.29 3.95 -0.15 12.44 2.02 -1.26 -1.30 118.70 134.10 1t5r s GLU 225 Ca -0.04 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 54.63 1t5r s GLU 225 Cb -0.03 -3.22 0.01 0.00 0.10 0.00 0.00 34.13 30.99 1t5r s GLU 225 CO 0.01 0.31 -0.19 -0.06 0.02 0.00 0.00 175.26 175.35 1t5r s PHE 226 N 0.28 2.73 -0.29 1.61 0.08 0.19 -4.05 117.98 118.54 1t5r s PHE 226 Ca 0.04 -1.28 -0.11 0.00 0.12 0.00 0.00 56.93 55.71 1t5r s PHE 226 Cb -0.12 -1.87 -0.04 0.00 -0.57 0.00 0.00 43.02 40.42 1t5r s PHE 226 CO 0.00 -0.59 0.18 -1.21 -0.10 0.00 0.00 175.22 173.49 1t5r s GLU 227 N 0.91 3.81 -0.11 0.44 2.02 -0.35 -0.09 118.70 125.33 1t5r s GLU 227 Ca -0.04 -0.41 -0.02 0.00 0.02 0.00 0.00 54.97 54.52 1t5r s GLU 227 Cb -0.15 -3.63 -0.03 0.00 0.10 0.00 0.00 34.13 30.42 1t5r s GLU 227 CO -0.03 -0.23 -0.03 0.42 0.02 0.00 0.00 175.26 175.41 1t5r s ILE 228 N 1.73 4.04 -0.10 -1.63 1.01 -0.27 -1.97 121.20 124.00 1t5r s ILE 228 Ca 0.07 -0.33 0.03 0.00 0.00 0.00 0.00 60.65 60.41 1t5r s ILE 228 Cb -0.16 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.60 1t5r s ILE 228 CO 0.10 0.56 -0.21 -0.89 0.00 0.00 0.00 174.94 174.50 1t5r s THR 229 N -0.36 1.85 -0.06 2.92 2.01 0.16 -1.52 115.64 120.63 1t5r s THR 229 Ca 0.06 -0.88 0.04 0.00 0.31 0.00 0.00 61.69 61.22 1t5r s THR 229 Cb -0.12 -1.62 0.00 0.00 0.01 0.00 0.00 72.50 70.77 1t5r s THR 229 CO 0.02 0.51 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.97 1t5r s TYR 230 N 0.58 1.89 0.00 4.92 1.51 -0.81 -0.85 117.35 124.59 1t5r s TYR 230 Ca -0.14 -0.65 0.00 0.00 -1.01 0.00 0.00 57.07 55.27 1t5r s TYR 230 Cb -0.17 -1.29 0.00 0.00 -0.11 0.00 0.00 41.96 40.39 1t5r s TYR 230 CO 0.04 -0.26 0.00 0.41 -1.11 0.00 0.00 175.55 174.63 1t5r n GLY 231 N 3.41 1.29 3.27 0.71 0.00 -0.61 0.54 105.19 113.80 1t5r n GLY 231 Ca -0.20 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.08 1t5r n GLY 231 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t5r s ARG 232 N 0.89 0.94 -0.18 1.61 0.52 -0.44 -1.28 118.95 121.02 1t5r s ARG 232 Ca 0.00 -0.75 -0.00 0.00 -0.52 0.00 0.00 55.73 54.46 1t5r s ARG 232 Cb 0.00 0.40 0.01 0.00 0.52 0.00 0.00 34.95 35.88 1t5r s ARG 232 CO 0.00 -0.34 -0.15 -0.80 0.02 0.00 0.00 175.30 174.04 1t5r s ASN 233 N -2.67 3.57 -0.09 0.23 0.01 0.16 -0.61 114.94 115.54 1t5r s ASN 233 Ca 0.02 -0.53 -0.05 0.00 -0.71 0.00 0.00 52.86 51.59 1t5r s ASN 233 Cb 0.02 -1.57 -0.04 0.00 0.41 0.00 0.00 41.25 40.08 1t5r s ASN 233 CO -0.10 0.02 0.11 -0.04 -1.51 0.00 0.00 177.10 175.58 1t5r s MET 234 N 1.17 3.30 0.20 -0.60 -1.94 0.27 -0.89 119.30 120.80 1t5r s MET 234 Ca 0.02 -0.24 0.08 0.00 -1.71 0.00 0.00 55.69 53.83 1t5r s MET 234 Cb -0.14 -3.06 -0.04 0.00 2.01 0.00 0.00 34.83 33.60 1t5r s MET 234 CO -0.06 0.74 0.01 -0.51 -0.01 0.00 0.00 175.02 175.19 1t5r s ASP 235 N -1.14 4.77 -0.10 3.03 1.11 0.10 -1.29 116.67 123.14 1t5r s ASP 235 Ca 0.16 -0.43 0.04 0.00 0.18 0.00 0.00 52.55 52.50 1t5r s ASP 235 Cb -0.12 -1.00 -0.00 0.00 1.07 0.00 0.00 42.92 42.87 1t5r s ASP 235 CO 0.06 0.07 -0.24 -0.69 1.18 0.00 0.00 175.17 175.55 1t5r s VAL 236 N -1.86 2.10 -0.21 -1.27 1.01 -0.90 -1.26 120.40 118.01 1t5r s VAL 236 Ca 0.28 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.22 1t5r s VAL 236 Cb -0.09 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1t5r s VAL 236 CO 0.19 0.56 -0.05 -0.89 0.00 0.00 0.00 175.10 174.91 1t5r s THR 237 N 0.35 3.32 -0.21 3.92 2.01 0.13 -0.90 115.64 124.26 1t5r s THR 237 Ca -0.18 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.19 1t5r s THR 237 Cb -0.18 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.78 1t5r s THR 237 CO 0.09 0.44 0.18 -1.00 -0.69 0.00 0.00 174.62 173.63 1t5r s HIS 238 N 1.36 3.37 -0.22 4.92 3.76 0.07 -0.90 115.29 127.65 1t5r s HIS 238 Ca 0.04 0.34 -0.07 0.00 -0.15 0.00 0.00 55.06 55.22 1t5r s HIS 238 Cb -0.14 -2.25 -0.03 0.00 1.11 0.00 0.00 32.58 31.27 1t5r s HIS 238 CO -0.03 0.17 0.06 0.00 -0.85 0.00 0.00 174.74 174.10 1t5r s ALA 239 N 0.72 3.23 -0.10 -1.40 0.00 0.01 -1.00 121.76 123.22 1t5r s ALA 239 Ca 0.09 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.10 1t5r s ALA 239 Cb -0.12 -1.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.99 1t5r s ALA 239 CO 0.02 -0.22 -0.19 0.99 0.00 0.00 0.00 175.76 176.36 1t5r s THR 240 N 1.12 2.57 0.11 0.00 2.01 0.68 -1.58 115.64 120.55 1t5r s THR 240 Ca 0.04 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 60.88 1t5r s THR 240 Cb -0.14 -2.02 -0.08 0.00 0.01 0.00 0.00 72.50 70.27 1t5r s THR 240 CO 0.03 0.55 1.38 -0.60 -0.69 0.00 0.00 174.62 175.29 1t5r s ARG 241 N 0.17 4.32 -0.05 4.92 3.52 -0.21 -0.87 118.95 130.75 1t5r s ARG 241 Ca -0.11 2.06 0.04 0.00 -0.13 0.00 0.00 55.73 57.59 1t5r s ARG 241 Cb -0.16 -3.26 -0.02 0.00 -1.56 0.00 0.00 34.95 29.94 1t5r s ARG 241 CO 0.06 -0.43 -0.16 1.03 -0.81 0.00 0.00 175.30 174.99 1t5r s ARG 242 N 1.15 2.52 -0.22 5.12 1.81 0.12 -4.93 118.95 124.52 1t5r s ARG 242 Ca 0.64 -0.73 0.00 0.00 -1.72 0.00 0.00 55.73 53.93 1t5r s ARG 242 Cb -0.36 -2.35 0.05 0.00 -0.45 0.00 0.00 34.95 31.84 1t5r s ARG 242 CO 0.30 0.58 -0.05 0.99 -0.68 0.00 0.00 175.30 176.44 1t5r s THR 243 N -0.63 1.41 0.18 0.02 2.01 -1.26 -1.13 115.64 116.24 1t5r s THR 243 Ca 0.09 -1.05 -0.05 0.00 0.31 0.00 0.00 61.69 60.99 1t5r s THR 243 Cb -0.11 -1.65 -0.05 0.00 0.01 0.00 0.00 72.50 70.70 1t5r s THR 243 CO 0.01 -0.03 1.50 0.71 -0.69 0.00 0.00 174.62 176.11 1t5r h THR 244 N 6.57 1.30 -1.54 -0.82 1.35 -1.78 -3.46 112.91 114.53 1t5r h THR 244 Ca -0.20 -1.70 0.08 0.00 -0.55 0.00 0.00 66.41 64.03 1t5r h THR 244 Cb 1.09 1.64 -0.27 0.00 -1.73 0.00 0.00 68.15 68.87 1t5r h THR 244 CO 0.41 0.54 0.51 -1.38 -0.25 0.00 0.00 175.52 175.35 1t5r s HIS 245 N -4.14 -0.42 -0.05 4.73 -3.43 -1.23 -5.06 115.29 105.69 1t5r s HIS 245 Ca -0.09 1.01 -0.04 0.00 -0.80 0.00 0.00 55.06 55.14 1t5r s HIS 245 Cb 0.11 0.38 -0.02 0.00 -1.43 0.00 0.00 32.58 31.63 1t5r s HIS 245 CO 0.85 -0.21 0.18 0.66 -2.00 0.00 0.00 174.74 174.22 1t5r n TYR 246 N 2.03 0.12 0.00 0.38 0.53 -1.26 0.36 117.16 119.32 1t5r n TYR 246 Ca -0.12 0.08 0.00 0.00 -1.02 0.00 0.00 57.90 56.84 1t5r n TYR 246 Cb 0.56 -0.21 0.00 0.00 -1.03 0.00 0.00 39.34 38.66 1t5r n TYR 246 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1t5r n GLY 247 N 0.59 1.48 3.09 2.72 0.00 -1.26 -5.02 105.19 106.79 1t5r n GLY 247 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1t5r n GLY 247 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1t5r s ASN 248 N -2.34 4.86 0.20 1.61 2.47 0.16 -5.10 114.94 116.81 1t5r s ASN 248 Ca 0.00 -1.80 0.02 0.00 0.42 0.00 0.00 52.86 51.50 1t5r s ASN 248 Cb 0.00 -1.68 -0.05 0.00 -1.45 0.00 0.00 41.25 38.07 1t5r s ASN 248 CO 0.00 -0.36 0.03 -0.44 -3.72 0.00 0.00 177.10 172.61 1t5r s SER 249 N 1.25 1.26 0.26 -4.21 0.01 -1.26 -1.91 113.70 109.10 1t5r s SER 249 Ca 0.03 -1.24 -0.15 0.00 1.31 0.00 0.00 55.95 55.90 1t5r s SER 249 Cb -0.20 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.15 1t5r s SER 249 CO -0.05 -0.61 0.56 -0.72 0.41 0.00 0.00 173.24 172.83 1t5r s TYR 250 N -3.66 0.18 -0.13 2.43 1.13 -0.28 -4.90 117.35 112.12 1t5r s TYR 250 Ca 0.29 -0.58 -0.05 0.00 -1.41 0.00 0.00 57.07 55.32 1t5r s TYR 250 Cb 0.07 0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 41.25 1t5r s TYR 250 CO 0.07 -1.08 0.06 -0.51 -2.51 0.00 0.00 175.55 171.59 1t5r s LEU 251 N -2.99 3.91 -0.07 -3.49 1.43 -1.26 0.14 118.68 116.36 1t5r s LEU 251 Ca 0.19 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.57 1t5r s LEU 251 Cb -0.02 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 1t5r s LEU 251 CO 0.08 0.33 -0.23 -0.70 0.23 0.00 0.00 176.35 176.06 1t5r s GLU 252 N -0.55 2.57 0.11 1.70 2.12 -0.05 -4.90 118.70 119.69 1t5r s GLU 252 Ca 0.11 -0.84 -0.02 0.00 0.36 0.00 0.00 54.97 54.58 1t5r s GLU 252 Cb -0.12 -2.10 -0.05 0.00 0.26 0.00 0.00 34.13 32.13 1t5r s GLU 252 CO 0.02 0.29 0.29 0.20 -0.54 0.00 0.00 175.26 175.53 1t5r s GLY 253 N 0.03 2.15 0.03 -1.50 0.00 -1.26 -0.23 107.32 106.54 1t5r s GLY 253 Ca -0.08 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 43.90 1t5r s GLY 253 CO 0.05 -0.70 -0.04 -1.35 0.00 0.00 0.00 173.10 171.05 1t5r s SER 254 N -2.57 0.42 0.11 1.64 1.04 -0.17 -4.44 113.70 109.72 1t5r s SER 254 Ca 0.37 -0.53 0.10 0.00 0.48 0.00 0.00 55.95 56.38 1t5r s SER 254 Cb -0.12 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.04 1t5r s SER 254 CO 0.27 -0.28 -0.25 -0.60 0.98 0.00 0.00 173.24 173.36 1t5r s ARG 255 N -1.55 1.33 -0.55 4.02 6.06 -1.26 -0.75 118.95 126.25 1t5r s ARG 255 Ca -0.14 -1.25 0.00 0.00 -2.50 0.00 0.00 55.73 51.84 1t5r s ARG 255 Cb -0.10 -1.72 0.14 0.00 0.06 0.00 0.00 34.95 33.34 1t5r s ARG 255 CO -0.01 0.41 0.32 0.42 -2.50 0.00 0.00 175.30 173.94 1t5r s ILE 256 N -1.07 3.15 0.31 4.11 1.01 -0.08 -5.01 121.20 123.64 1t5r s ILE 256 Ca 0.11 -2.97 -0.28 0.00 0.00 0.00 0.00 60.65 57.51 1t5r s ILE 256 Cb -0.10 -3.12 -0.09 0.00 0.01 0.00 0.00 42.46 39.15 1t5r s ILE 256 CO 0.05 -0.81 1.12 -2.28 0.00 0.00 0.00 174.94 173.02 1t5r s HIS 257 N 0.03 3.45 -1.30 3.97 2.46 -1.26 -2.11 115.29 120.53 1t5r s HIS 257 Ca 0.16 1.66 -0.03 0.00 0.47 0.00 0.00 55.06 57.31 1t5r s HIS 257 Cb -0.22 -3.31 0.01 0.00 -0.13 0.00 0.00 32.58 28.93 1t5r s HIS 257 CO -0.03 -0.74 0.93 0.09 -2.47 0.00 0.00 174.74 172.52 1t5r n ASN 258 N 0.90 -2.77 -0.03 9.88 3.02 -1.26 -4.92 115.26 120.08 1t5r n ASN 258 Ca 0.00 -0.69 -0.13 0.00 -0.03 0.00 0.00 54.58 53.74 1t5r n ASN 258 Cb 0.45 -4.63 -0.08 0.00 -0.61 0.00 0.00 39.78 34.91 1t5r n ASN 258 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1t5r h ALA 259 N 0.92 0.10 -3.35 5.41 0.00 -1.25 -3.40 119.26 117.69 1t5r h ALA 259 Ca -0.59 -0.24 -0.61 0.00 0.00 0.00 0.00 54.91 53.46 1t5r h ALA 259 Cb 1.35 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.72 1t5r h ALA 259 CO 0.55 -0.15 -0.74 -0.06 0.00 0.00 0.00 179.25 178.85 1t5r s PHE 260 N -4.51 2.48 -0.08 0.00 0.40 -0.41 -4.98 117.98 110.87 1t5r s PHE 260 Ca -0.15 -2.24 -0.08 0.00 -0.60 0.00 0.00 56.93 53.86 1t5r s PHE 260 Cb 0.04 -2.18 -0.04 0.00 0.51 0.00 0.00 43.02 41.35 1t5r s PHE 260 CO 0.70 -0.90 0.21 0.08 0.70 0.00 0.00 175.22 176.01 1t5r s VAL 261 N 1.30 5.39 -1.09 -0.44 1.01 -1.26 0.94 120.40 126.24 1t5r s VAL 261 Ca 0.11 0.30 -0.03 0.00 0.00 0.00 0.00 61.98 62.36 1t5r s VAL 261 Cb -0.18 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1t5r s VAL 261 CO -0.18 0.57 0.93 0.59 0.00 0.00 0.00 175.10 177.01 1t5r n ASN 262 N 1.80 -3.40 -4.55 3.32 3.02 -1.19 -4.90 115.26 109.36 1t5r n ASN 262 Ca -0.17 -0.51 -0.43 0.00 -0.03 0.00 0.00 54.58 53.43 1t5r n ASN 262 Cb 0.54 -4.50 -0.01 0.00 -0.61 0.00 0.00 39.78 35.20 1t5r n ASN 262 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1t5r s ARG 263 N -5.53 3.91 0.11 3.52 1.81 0.22 -4.90 118.95 118.10 1t5r s ARG 263 Ca 0.18 -1.94 0.10 0.00 -1.72 0.00 0.00 55.73 52.36 1t5r s ARG 263 Cb -0.08 -5.37 -0.04 0.00 -0.45 0.00 0.00 34.95 29.01 1t5r s ARG 263 CO 0.64 -2.12 -0.23 -0.80 -0.68 0.00 0.00 175.30 172.10 1t5r s ASN 264 N 4.06 3.55 -0.35 0.23 0.01 -1.26 -1.32 114.94 119.85 1t5r s ASN 264 Ca 0.49 -0.65 -0.10 0.00 -0.71 0.00 0.00 52.86 51.89 1t5r s ASN 264 Cb 0.01 -0.37 0.01 0.00 0.41 0.00 0.00 41.25 41.31 1t5r s ASN 264 CO 0.02 0.19 0.19 -0.47 -1.51 0.00 0.00 177.10 175.51 1t5r s TYR 265 N -1.06 3.22 -0.18 2.20 6.04 0.19 -4.95 117.35 122.79 1t5r s TYR 265 Ca 0.15 -0.80 -0.03 0.00 0.04 0.00 0.00 57.07 56.44 1t5r s TYR 265 Cb -0.10 -2.41 -0.01 0.00 -1.04 0.00 0.00 41.96 38.40 1t5r s TYR 265 CO 0.07 -0.57 -0.07 0.99 -1.54 0.00 0.00 175.55 174.43 1t5r s THR 266 N 1.58 3.33 -0.04 4.34 2.01 -1.26 -1.93 115.64 123.66 1t5r s THR 266 Ca 0.03 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.54 1t5r s THR 266 Cb -0.18 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1t5r s THR 266 CO 0.07 0.46 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.63 1t5r s VAL 267 N 1.00 3.12 -0.25 3.82 1.01 -0.57 -2.57 120.40 125.95 1t5r s VAL 267 Ca -0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 1t5r s VAL 267 Cb -0.15 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1t5r s VAL 267 CO -0.00 0.55 0.05 -1.59 0.00 0.00 0.00 175.10 174.11 1t5r s LYS 268 N -0.87 3.55 -0.14 2.72 0.00 0.16 -1.11 119.74 124.06 1t5r s LYS 268 Ca 0.12 -0.54 -0.01 0.00 0.00 0.00 0.00 55.97 55.54 1t5r s LYS 268 Cb -0.11 -3.27 -0.02 0.00 0.00 0.00 0.00 37.83 34.44 1t5r s LYS 268 CO 0.02 -0.21 -0.11 0.71 0.00 0.00 0.00 175.35 175.76 1t5r s TYR 269 N 1.58 2.87 -0.24 1.78 1.51 0.87 -1.19 117.35 124.53 1t5r s TYR 269 Ca 0.06 -0.55 -0.07 0.00 -1.01 0.00 0.00 57.07 55.50 1t5r s TYR 269 Cb -0.15 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.80 1t5r s TYR 269 CO 0.02 -0.16 0.06 -2.00 -1.11 0.00 0.00 175.55 172.36 1t5r s GLU 270 N 0.34 3.66 0.05 -0.62 2.12 0.14 0.55 118.70 124.95 1t5r s GLU 270 Ca -0.09 -0.48 0.03 0.00 0.36 0.00 0.00 54.97 54.79 1t5r s GLU 270 Cb -0.15 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 1t5r s GLU 270 CO 0.05 -0.15 0.01 0.14 -0.54 0.00 0.00 175.26 174.78 1t5r s VAL 271 N 1.49 4.16 -0.30 3.70 -7.23 -0.42 -0.80 120.40 121.00 1t5r s VAL 271 Ca 0.06 -0.81 -0.06 0.00 -1.81 0.00 0.00 61.98 59.36 1t5r s VAL 271 Cb -0.15 -2.94 0.02 0.00 0.56 0.00 0.00 36.38 33.87 1t5r s VAL 271 CO 0.03 0.21 0.06 0.21 -0.31 0.00 0.00 175.10 175.31 1t5r s ASN 272 N -2.05 5.04 0.53 4.85 3.04 -0.79 -2.15 114.94 123.41 1t5r s ASN 272 Ca 0.24 -0.89 0.26 0.00 0.04 0.00 0.00 52.86 52.52 1t5r s ASN 272 Cb -0.12 -1.83 1.47 0.00 -1.54 0.00 0.00 41.25 39.23 1t5r s ASN 272 CO 0.16 -0.22 2.10 -0.50 -3.04 0.00 0.00 177.10 175.60 1t5r h TRP 273 N 8.18 0.00 0.00 0.43 4.06 -0.16 0.39 115.95 128.86 1t5r h TRP 273 Ca -0.29 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.53 1t5r h TRP 273 Cb 1.11 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.25 1t5r h TRP 273 CO 0.60 0.10 -0.95 1.63 -3.56 0.00 0.00 178.44 176.26 1t5r n LYS 274 N -3.77 0.51 0.14 0.49 5.02 -1.26 -4.51 118.16 114.78 1t5r n LYS 274 Ca -0.02 0.54 0.05 0.00 -2.02 0.00 0.00 58.31 56.86 1t5r n LYS 274 Cb 0.21 -1.71 0.04 0.00 -0.02 0.00 0.00 35.03 33.54 1t5r n LYS 274 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1t5r h THR 275 N -1.00 0.56 -0.64 -0.18 1.35 -1.90 -3.48 112.91 107.63 1t5r h THR 275 Ca -0.20 -1.83 -0.17 0.00 -0.55 0.00 0.00 66.41 63.66 1t5r h THR 275 Cb 0.95 2.22 -0.05 0.00 -1.73 0.00 0.00 68.15 69.54 1t5r h THR 275 CO -0.12 0.32 -0.17 1.41 -0.25 0.00 0.00 175.52 176.71 1t5r n HIS 276 N -3.12 -0.12 -3.17 4.73 -0.00 0.14 -5.02 115.22 108.66 1t5r n HIS 276 Ca 0.01 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.35 1t5r n HIS 276 Cb 0.69 -1.84 -0.06 0.00 -0.00 0.00 0.00 29.99 28.78 1t5r n HIS 276 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.34 174.34 1t5r s GLU 277 N -3.23 4.26 -0.15 -0.41 2.12 -1.25 -4.83 118.70 115.22 1t5r s GLU 277 Ca 0.00 0.83 -0.02 0.00 0.36 0.00 0.00 54.97 56.14 1t5r s GLU 277 Cb 0.00 -3.09 -0.02 0.00 0.26 0.00 0.00 34.13 31.28 1t5r s GLU 277 CO 0.00 0.53 -0.08 0.42 -0.54 0.00 0.00 175.26 175.59 1t5r s ILE 278 N -1.29 3.45 -0.05 -3.70 -1.09 -1.26 -1.88 121.20 115.38 1t5r s ILE 278 Ca 0.36 -0.51 0.06 0.00 -2.23 0.00 0.00 60.65 58.32 1t5r s ILE 278 Cb -0.19 -2.49 -0.01 0.00 -1.58 0.00 0.00 42.46 38.19 1t5r s ILE 278 CO 0.21 0.50 -0.22 -0.54 -1.23 0.00 0.00 174.94 173.66 1t5r s LYS 279 N 0.50 2.21 -0.62 2.79 1.02 0.02 -4.96 119.74 120.69 1t5r s LYS 279 Ca -0.06 -0.79 -0.20 0.00 0.02 0.00 0.00 55.97 54.94 1t5r s LYS 279 Cb -0.15 -1.91 0.09 0.00 -0.52 0.00 0.00 37.83 35.35 1t5r s LYS 279 CO 0.03 0.34 0.80 0.08 -0.92 0.00 0.00 175.35 175.68 1t5r s VAL 280 N -0.12 4.65 0.21 3.17 1.01 -1.26 0.26 120.40 128.32 1t5r s VAL 280 Ca -0.03 -0.80 0.21 0.00 0.00 0.00 0.00 61.98 61.37 1t5r s VAL 280 Cb -0.12 -4.56 0.18 0.00 0.00 0.00 0.00 36.38 31.88 1t5r s VAL 280 CO 0.03 -1.25 1.82 0.11 0.00 0.00 0.00 175.10 175.81 1t5r h LYS 281 N 9.31 0.00 0.00 2.72 1.79 -1.52 -3.48 116.57 125.39 1t5r h LYS 281 Ca -0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1t5r h LYS 281 Cb 1.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 1t5r h LYS 281 CO 1.13 0.29 0.00 0.41 -1.08 0.00 0.00 179.45 180.20 1t5r n GLY 282 N 0.02 0.14 3.81 3.86 0.00 -1.23 -5.01 105.19 106.78 1t5r n GLY 282 Ca -0.00 -1.16 -0.07 0.00 0.00 0.00 0.00 46.02 44.79 1t5r n GLY 282 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1t5r s HIS 283 N -2.00 -0.22 -2.05 1.61 -3.43 -1.26 -0.66 115.29 107.28 1t5r s HIS 283 Ca 0.00 -0.20 0.16 0.00 -0.80 0.00 0.00 55.06 54.22 1t5r s HIS 283 Cb 0.00 0.69 0.13 0.00 -1.43 0.00 0.00 32.58 31.97 1t5r s HIS 283 CO 0.00 -1.16 1.02 0.27 -2.00 0.00 0.00 174.74 172.87